methyl 4-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[(3,4-dimethylphenyl)methyl]-1-piperazinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(3,4-dimethylbenzyl)piperazino]-4-keto-butyric acid methyl ester Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CCC(=O)OC)C

InChI

InChI=1S/C18H26N2O3/c1-14-4-5-16(12-15(14)2)13-19-8-10-20(11-9-19)17(21)6-7-18(22)23-3/h4-5,12H,6-11,13H2,1-3H3