3-[(4-methoxyphenyl)carbonylamino]-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzoic acid

Systemtic Name: 3-[(4-methoxyphenyl)carbonylamino]-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzoic acid Openeye Name: 3-[(4-methoxybenzoyl)amino]-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzoic acid CAS Name: 3-[[(4-methoxyphenyl)-oxomethyl]amino]-4-[4-(2-methoxyphenyl)-1-piperazinyl]benzoic acid IUPAC Name: 3-[(4-methoxybenzoyl)amino]-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzoic acid Traditional Name: 4-[4-(2-methoxyphenyl)piperazino]-3-(p-anisoylamino)benzoic acid Formula: C26H27N3O5 MolecularWeight: 461.50968

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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=C4OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C26H27N3O5/c1-33-20-10-7-18(8-11-20)25(30)27-21-17-19(26(31)32)9-12-22(21)28-13-15-29(16-14-28)23-5-3-4-6-24(23)34-2/h3-12,17H,13-16H2,1-2H3,(H,27,30)(H,31,32)