3-[(4-methoxyphenyl)carbonylamino]-4-(4-phenylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-[(4-methoxyphenyl)carbonylamino]-4-(4-phenylpiperazin-1-yl)benzoic acid Openeye Name: 3-[(4-methoxybenzoyl)amino]-4-(4-phenylpiperazin-1-yl)benzoic acid CAS Name: 3-[[(4-methoxyphenyl)-oxomethyl]amino]-4-(4-phenyl-1-piperazinyl)benzoic acid IUPAC Name: 3-[(4-methoxybenzoyl)amino]-4-(4-phenylpiperazin-1-yl)benzoic acid Traditional Name: 3-(p-anisoylamino)-4-(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=C(C=CC(=C2)C(=O)O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O4/c1-32-21-10-7-18(8-11-21)24(29)26-22-17-19(25(30)31)9-12-23(22)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)