2-[4-(4-fluorophenyl)piperazin-1-yl]-5-[(4-methoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-[(4-methoxyphenyl)carbonylamino]benzoic acid Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-[(4-methoxybenzoyl)amino]benzoic acid CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-5-[[(4-methoxyphenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-5-[(4-methoxybenzoyl)amino]benzoic acid Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-5-(p-anisoylamino)benzoic acid Formula: C25H24FN3O4 MolecularWeight: 449.474163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C25H24FN3O4/c1-33-21-9-2-17(3-10-21)24(30)27-19-6-11-23(22(16-19)25(31)32)29-14-12-28(13-15-29)20-7-4-18(26)5-8-20/h2-11,16H,12-15H2,1H3,(H,27,30)(H,31,32)