5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid

Systemtic Name: 5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid Openeye Name: 5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)isoindolin-5-yl]amino]benzoic acid CAS Name: 5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid IUPAC Name: 5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid Traditional Name: 5-methoxy-2-[[2-(2,3,4-trimethoxyphenyl)isoindolin-5-yl]amino]benzoic acid Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=CC3=C(CN(C3)C4=C(C(=C(C=C4)OC)OC)OC)C=C2)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=CC3=C(CN(C3)C4=C(C(=C(C=C4)OC)OC)OC)C=C2)C(=O)O

InChI

InChI=1S/C25H26N2O6/c1-30-18-7-8-20(19(12-18)25(28)29)26-17-6-5-15-13-27(14-16(15)11-17)21-9-10-22(31-2)24(33-4)23(21)32-3/h5-12,26H,13-14H2,1-4H3,(H,28,29)