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

Systemtic Name: ethyl 4-[[3-(propylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[3-(propylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[3-[oxo(propylamino)methyl]-4-(1-pyrrolidinyl)anilino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(propylcarbamoyl)-4-pyrrolidin-1-ylphenyl]carbamoylamino]benzoate Traditional Name: 4-[[3-(propylcarbamoyl)-4-pyrrolidino-phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C24H30N4O4 MolecularWeight: 438.5194

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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)N3CCCC3

Isomeric SMILES

CCCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(=O)OCC)N3CCCC3

InChI

InChI=1S/C24H30N4O4/c1-3-13-25-22(29)20-16-19(11-12-21(20)28-14-5-6-15-28)27-24(31)26-18-9-7-17(8-10-18)23(30)32-4-2/h7-12,16H,3-6,13-15H2,1-2H3,(H,25,29)(H2,26,27,31)