(phenylmethyl) 2-[(4-methoxyphenyl)methyl]-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoate hydrochloride

Systemtic Name: (phenylmethyl) 2-[(4-methoxyphenyl)methyl]-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoate hydrochloride Openeye Name: benzyl 2-[(4-methoxyphenyl)methyl]-4-(4-methylpiperazin-1-yl)-4-oxo-butanoate hydrochloride CAS Name: 2-[(4-methoxyphenyl)methyl]-4-(4-methyl-1-piperazinyl)-4-oxobutanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-[(4-methoxyphenyl)methyl]-4-(4-methylpiperazin-1-yl)-4-oxobutanoate hydrochloride Traditional Name: 4-keto-4-(4-methylpiperazino)-2-p-anisyl-butyric acid benzyl ester hydrochloride Formula: C24H31ClN2O4 MolecularWeight: 446.96694

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC(CC2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)CC(CC2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C24H30N2O4.ClH/c1-25-12-14-26(15-13-25)23(27)17-21(16-19-8-10-22(29-2)11-9-19)24(28)30-18-20-6-4-3-5-7-20;/h3-11,21H,12-18H2,1-2H3;1H