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

Systemtic Name: ethyl 4-[[3-(3-ethoxypropylcarbamoyl)-4-(4-methylpiperidin-1-yl)phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[3-(3-ethoxypropylcarbamoyl)-4-(4-methyl-1-piperidyl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[[3-[(3-ethoxypropylamino)-oxomethyl]-4-(4-methyl-1-piperidinyl)anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(3-ethoxypropylcarbamoyl)-4-(4-methylpiperidin-1-yl)phenyl]carbamoylamino]benzoate Traditional Name: 4-[[3-(3-ethoxypropylcarbamoyl)-4-(4-methylpiperidino)phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C28H38N4O5 MolecularWeight: 510.62512

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OCC)N3CCC(CC3)C

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OCC)N3CCC(CC3)C

InChI

InChI=1S/C28H38N4O5/c1-4-36-18-6-15-29-26(33)24-19-23(11-12-25(24)32-16-13-20(3)14-17-32)31-28(35)30-22-9-7-21(8-10-22)27(34)37-5-2/h7-12,19-20H,4-6,13-18H2,1-3H3,(H,29,33)(H2,30,31,35)