methyl 2-[4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]phenyl]ethanoate Openeye Name: methyl 2-[4-[(4-benzhydrylpiperazin-1-yl)methyl]phenyl]acetate CAS Name: 2-[4-[[4-(diphenylmethyl)-1-piperazinyl]methyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(4-benzhydrylpiperazin-1-yl)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-benzhydrylpiperazino)methyl]phenyl]acetic acid methyl ester Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N2O2/c1-31-26(30)20-22-12-14-23(15-13-22)21-28-16-18-29(19-17-28)27(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-15,27H,16-21H2,1H3