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

Systemtic Name: 5-[(4-methoxyphenyl)carbonylamino]-2-(4-phenylpiperazin-1-yl)benzoic acid Openeye Name: 5-[(4-methoxybenzoyl)amino]-2-(4-phenylpiperazin-1-yl)benzoic acid CAS Name: 5-[[(4-methoxyphenyl)-oxomethyl]amino]-2-(4-phenyl-1-piperazinyl)benzoic acid IUPAC Name: 5-[(4-methoxybenzoyl)amino]-2-(4-phenylpiperazin-1-yl)benzoic acid Traditional Name: 5-(p-anisoylamino)-2-(4-phenylpiperazino)benzoic acid Formula: C25H25N3O4 MolecularWeight: 431.4837

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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=CC=C4)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O4/c1-32-21-10-7-18(8-11-21)24(29)26-19-9-12-23(22(17-19)25(30)31)28-15-13-27(14-16-28)20-5-3-2-4-6-20/h2-12,17H,13-16H2,1H3,(H,26,29)(H,30,31)