P 276-00

CAS Registry Number®

920113-03-7
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CAS Name

P 276-00

Molecular Formula

C21H20ClNO5.ClH

Cite this Page

P 276-00.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=920113-03-7 (retrieved 2024-05-02) (CAS RN: 920113-03-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H20ClNO5.ClH/c1-23-7-6-12(14(23)10-24)19-15(25)8-16(26)20-17(27)9-18(28-21(19)20)11-4-2-3-5-13(11)22;/h2-5,8-9,12,14,24-26H,6-7,10H2,1H3;1H/t12-,14+;/m1./s1

InChIKey

InChIKey=OOVTUOCTLAERQD-OJMBIDBESA-N

SMILES

OC=1C(=C2C(C(=O)C=C(O2)C3=C(Cl)C=CC=C3)=C(O)C1)[C@H]4[C@H](CO)N(C)CC4.Cl

Canonical SMILES

Cl.O=C1C=C(OC=2C1=C(O)C=C(O)C2C3CCN(C)C3CO)C=4C=CC=CC4Cl

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-, hydrochloride (1:1)
  • P 276-00

Deleted or Replaced CAS Registry Numbers

936749-12-1

CAS INSIGHTSTM
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