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

Systemtic Name: ethyl 4-[[4-piperidin-1-yl-3-(propylcarbamoyl)phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-(1-piperidyl)-3-(propylcarbamoyl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[3-[oxo(propylamino)methyl]-4-(1-piperidinyl)anilino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-piperidin-1-yl-3-(propylcarbamoyl)phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-piperidino-3-(propylcarbamoyl)phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OCC)N3CCCCC3

Isomeric SMILES

CCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OCC)N3CCCCC3

InChI

InChI=1S/C25H32N4O4/c1-3-14-26-23(30)21-17-20(12-13-22(21)29-15-6-5-7-16-29)28-25(32)27-19-10-8-18(9-11-19)24(31)33-4-2/h8-13,17H,3-7,14-16H2,1-2H3,(H,26,30)(H2,27,28,32)