3-[(4-chlorophenyl)carbonylamino]-4-(4-cyclohexylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-[(4-chlorophenyl)carbonylamino]-4-(4-cyclohexylpiperazin-1-yl)benzoic acid Openeye Name: 3-[(4-chlorobenzoyl)amino]-4-(4-cyclohexylpiperazin-1-yl)benzoic acid CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]-4-(4-cyclohexyl-1-piperazinyl)benzoic acid IUPAC Name: 3-[(4-chlorobenzoyl)amino]-4-(4-cyclohexylpiperazin-1-yl)benzoic acid Traditional Name: 3-[(4-chlorobenzoyl)amino]-4-(4-cyclohexylpiperazino)benzoic acid Formula: C24H28ClN3O3 MolecularWeight: 441.95042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)O)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)O)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H28ClN3O3/c25-19-9-6-17(7-10-19)23(29)26-21-16-18(24(30)31)8-11-22(21)28-14-12-27(13-15-28)20-4-2-1-3-5-20/h6-11,16,20H,1-5,12-15H2,(H,26,29)(H,30,31)