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

Systemtic Name: 2-[2-[1-[bis(4-methylphenyl)methyl]piperazin-2-yl]ethyl]-3-oxidanylidene-butanoate Openeye Name: 2-[2-[1-(bis-p-tolylmethyl)piperazin-2-yl]ethyl]-3-oxo-butanoate CAS Name: 2-[2-[1-[bis(4-methylphenyl)methyl]-2-piperazinyl]ethyl]-3-oxobutanoate IUPAC Name: 2-[2-[1-[bis(4-methylphenyl)methyl]piperazin-2-yl]ethyl]-3-oxobutanoate Traditional Name: 2-[2-[1-(bis-p-tolylmethyl)piperazin-2-yl]ethyl]-3-keto-butyrate Formula: C25H31N2O3- MolecularWeight: 407.52524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CCNCC3CCC(C(=O)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)N3CCNCC3CCC(C(=O)C)C(=O)[O-]

InChI

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