ethyl 4-[2-[4-(2-chlorophenyl)piperazin-1-yl]propanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(2-chlorophenyl)piperazin-1-yl]propanoylamino]benzoate Openeye Name: ethyl 4-[2-[4-(2-chlorophenyl)piperazin-1-yl]propanoylamino]benzoate CAS Name: 4-[[2-[4-(2-chlorophenyl)-1-piperazinyl]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(2-chlorophenyl)piperazin-1-yl]propanoylamino]benzoate Traditional Name: 4-[2-[4-(2-chlorophenyl)piperazino]propanoylamino]benzoic acid ethyl ester Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O3/c1-3-29-22(28)17-8-10-18(11-9-17)24-21(27)16(2)25-12-14-26(15-13-25)20-7-5-4-6-19(20)23/h4-11,16H,3,12-15H2,1-2H3,(H,24,27)