1-[2-(1-oxidanylbutyl)-1H-pyrrol-3-yl]-5-phenyl-pentan-1-one hydrochloride

Systemtic Name: 1-[2-(1-oxidanylbutyl)-1H-pyrrol-3-yl]-5-phenyl-pentan-1-one hydrochloride Openeye Name: 1-[2-(1-hydroxybutyl)-1H-pyrrol-3-yl]-5-phenyl-pentan-1-one hydrochloride CAS Name: 1-[2-(1-hydroxybutyl)-1H-pyrrol-3-yl]-5-phenyl-1-pentanone hydrochloride IUPAC Name: 1-[2-(1-hydroxybutyl)-1H-pyrrol-3-yl]-5-phenylpentan-1-one hydrochloride Traditional Name: 1-[2-(1-hydroxybutyl)-1H-pyrrol-3-yl]-5-phenyl-pentan-1-one hydrochloride Formula: C19H26ClNO2 MolecularWeight: 335.86824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=CN1)C(=O)CCCCC2=CC=CC=C2)O.Cl

Isomeric SMILES

CCCC(C1=C(C=CN1)C(=O)CCCCC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C19H25NO2.ClH/c1-2-8-18(22)19-16(13-14-20-19)17(21)12-7-6-11-15-9-4-3-5-10-15;/h3-5,9-10,13-14,18,20,22H,2,6-8,11-12H2,1H3;1H