4-[4-(3-methoxy-5-oxidanylidene-1-piperidin-4-yl-2H-pyrrol-4-yl)phenyl]butanoic acid hydrochloride

Systemtic Name: 4-[4-(3-methoxy-5-oxidanylidene-1-piperidin-4-yl-2H-pyrrol-4-yl)phenyl]butanoic acid hydrochloride Openeye Name: 4-[4-[3-methoxy-5-oxo-1-(4-piperidyl)-2H-pyrrol-4-yl]phenyl]butanoic acid hydrochloride CAS Name: 4-[4-[3-methoxy-5-oxo-1-(4-piperidinyl)-2H-pyrrol-4-yl]phenyl]butanoic acid hydrochloride IUPAC Name: 4-[4-(3-methoxy-5-oxo-1-piperidin-4-yl-2H-pyrrol-4-yl)phenyl]butanoic acid hydrochloride Traditional Name: 4-[4-[2-keto-4-methoxy-1-(4-piperidyl)-3-pyrrolin-3-yl]phenyl]butyric acid hydrochloride Formula: C20H27ClN2O4 MolecularWeight: 394.89238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)N(C1)C2CCNCC2)C3=CC=C(C=C3)CCCC(=O)O.Cl

Isomeric SMILES

COC1=C(C(=O)N(C1)C2CCNCC2)C3=CC=C(C=C3)CCCC(=O)O.Cl

InChI

InChI=1S/C20H26N2O4.ClH/c1-26-17-13-22(16-9-11-21-12-10-16)20(25)19(17)15-7-5-14(6-8-15)3-2-4-18(23)24;/h5-8,16,21H,2-4,9-13H2,1H3,(H,23,24);1H