ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propylcarbamoylamino]-2-methoxy-benzoate

Systemtic Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propylcarbamoylamino]-2-methoxy-benzoate Openeye Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propylcarbamoylamino]-2-methoxy-benzoate CAS Name: 5-[[[3-[4-(4-chlorophenyl)-1-piperazinyl]propylamino]-oxomethyl]amino]-2-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propylcarbamoylamino]-2-methoxybenzoate Traditional Name: 5-[3-[4-(4-chlorophenyl)piperazino]propylcarbamoylamino]-2-methoxy-benzoic acid ethyl ester Formula: C24H31ClN4O4 MolecularWeight: 474.98034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C24H31ClN4O4/c1-3-33-23(30)21-17-19(7-10-22(21)32-2)27-24(31)26-11-4-12-28-13-15-29(16-14-28)20-8-5-18(25)6-9-20/h5-10,17H,3-4,11-16H2,1-2H3,(H2,26,27,31)