ethyl 4-(4-ethanoylpiperazin-1-yl)-3-[(3-methylphenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethanoylpiperazin-1-yl)-3-[(3-methylphenyl)carbonylamino]benzoate Openeye Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-methylbenzoyl)amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[(3-methylphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-methylbenzoyl)amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-(m-toluoylamino)benzoic acid ethyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)NC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)NC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C23H27N3O4/c1-4-30-23(29)19-8-9-21(26-12-10-25(11-13-26)17(3)27)20(15-19)24-22(28)18-7-5-6-16(2)14-18/h5-9,14-15H,4,10-13H2,1-3H3,(H,24,28)