2-[4-[bis(4-methylphenyl)methyl]piperazin-1-yl]ethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-[4-[bis(4-methylphenyl)methyl]piperazin-1-yl]ethyl 3-oxidanylidenebutanoate Openeye Name: 2-[4-(bis-p-tolylmethyl)piperazin-1-yl]ethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-[4-[bis(4-methylphenyl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[bis(4-methylphenyl)methyl]piperazin-1-yl]ethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-[4-(bis-p-tolylmethyl)piperazino]ethyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CCN(CC3)CCOC(=O)CC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CCN(CC3)CCOC(=O)CC(=O)C

InChI

InChI=1S/C25H32N2O3/c1-19-4-8-22(9-5-19)25(23-10-6-20(2)7-11-23)27-14-12-26(13-15-27)16-17-30-24(29)18-21(3)28/h4-11,25H,12-18H2,1-3H3