[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] 2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: [2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl] 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperazin-1-yl)-2-oxoethyl] 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid [2-(4-benzylpiperazino)-2-keto-ethyl] ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4/c1-18-6-5-9-20(14-18)23(29)24-15-22(28)30-17-21(27)26-12-10-25(11-13-26)16-19-7-3-2-4-8-19/h2-9,14H,10-13,15-17H2,1H3,(H,24,29)