[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 3-azanylbenzoate

Systemtic Name: [2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 3-azanylbenzoate Openeye Name: [2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl] 3-aminobenzoate CAS Name: 3-aminobenzoic acid [2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl] 3-aminobenzoate Traditional Name: 3-aminobenzoic acid [2-(4-benzhydrylpiperazino)-2-keto-ethyl] ester Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC(=O)C4=CC(=CC=C4)N

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC(=O)C4=CC(=CC=C4)N

InChI

InChI=1S/C26H27N3O3/c27-23-13-7-12-22(18-23)26(31)32-19-24(30)28-14-16-29(17-15-28)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,18,25H,14-17,19,27H2