ethyl 4-[[3-(4-methylpiperidin-1-yl)carbonyl-4-piperidin-1-yl-phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[3-(4-methylpiperidin-1-yl)carbonyl-4-piperidin-1-yl-phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[3-(4-methylpiperidine-1-carbonyl)-4-(1-piperidyl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[[3-[(4-methyl-1-piperidinyl)-oxomethyl]-4-(1-piperidinyl)anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-methylpiperidine-1-carbonyl)-4-piperidin-1-ylphenyl]carbamoylamino]benzoate Traditional Name: 4-[[3-(4-methylpiperidine-1-carbonyl)-4-piperidino-phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C28H36N4O4 MolecularWeight: 492.60984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)N4CCC(CC4)C

InChI

InChI=1S/C28H36N4O4/c1-3-36-27(34)21-7-9-22(10-8-21)29-28(35)30-23-11-12-25(31-15-5-4-6-16-31)24(19-23)26(33)32-17-13-20(2)14-18-32/h7-12,19-20H,3-6,13-18H2,1-2H3,(H2,29,30,35)