ethyl 4-[4-(phenylcarbonyl)piperazin-1-yl]-3-(propanoylamino)benzoate

Systemtic Name: ethyl 4-[4-(phenylcarbonyl)piperazin-1-yl]-3-(propanoylamino)benzoate Openeye Name: ethyl 4-(4-benzoylpiperazin-1-yl)-3-(propanoylamino)benzoate CAS Name: 4-(4-benzoyl-1-piperazinyl)-3-(1-oxopropylamino)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-benzoylpiperazin-1-yl)-3-(propanoylamino)benzoate Traditional Name: 4-(4-benzoylpiperazino)-3-propionamido-benzoic acid ethyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC)N2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC)N2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4/c1-3-21(27)24-19-16-18(23(29)30-4-2)10-11-20(19)25-12-14-26(15-13-25)22(28)17-8-6-5-7-9-17/h5-11,16H,3-4,12-15H2,1-2H3,(H,24,27)