5-[(4-chlorophenyl)carbonylamino]-2-(4-pentan-2-ylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-[(4-chlorophenyl)carbonylamino]-2-(4-pentan-2-ylpiperazin-1-yl)benzoic acid Openeye Name: 5-[(4-chlorobenzoyl)amino]-2-[4-(1-methylbutyl)piperazin-1-yl]benzoic acid CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]amino]-2-(4-pentan-2-yl-1-piperazinyl)benzoic acid IUPAC Name: 5-[(4-chlorobenzoyl)amino]-2-(4-pentan-2-ylpiperazin-1-yl)benzoic acid Traditional Name: 5-[(4-chlorobenzoyl)amino]-2-[4-(1-methylbutyl)piperazino]benzoic acid Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCC(C)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C23H28ClN3O3/c1-3-4-16(2)26-11-13-27(14-12-26)21-10-9-19(15-20(21)23(29)30)25-22(28)17-5-7-18(24)8-6-17/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,28)(H,29,30)