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

Systemtic Name: ethyl 4-[[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(C(C2)C)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(C(C2)C)C3=CC=CC(=C3)C

InChI

InChI=1S/C22H27N3O3/c1-4-28-21(26)18-8-10-19(11-9-18)23-22(27)24-12-13-25(17(3)15-24)20-7-5-6-16(2)14-20/h5-11,14,17H,4,12-13,15H2,1-3H3,(H,23,27)