2-[[4-(4-azanyl-3-methoxy-phenyl)-2-methoxy-phenyl]amino]benzoic acid

Systemtic Name: 2-[[4-(4-azanyl-3-methoxy-phenyl)-2-methoxy-phenyl]amino]benzoic acid Openeye Name: 2-[4-(4-amino-3-methoxy-phenyl)-2-methoxy-anilino]benzoic acid CAS Name: 2-[4-(4-amino-3-methoxyphenyl)-2-methoxyanilino]benzoic acid IUPAC Name: 2-[4-(4-amino-3-methoxyphenyl)-2-methoxyanilino]benzoic acid Traditional Name: 2-[4-(4-amino-3-methoxy-phenyl)-2-methoxy-anilino]benzoic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC3=CC=CC=C3C(=O)O)OC)N

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC3=CC=CC=C3C(=O)O)OC)N

InChI

InChI=1S/C21H20N2O4/c1-26-19-11-13(7-9-16(19)22)14-8-10-18(20(12-14)27-2)23-17-6-4-3-5-15(17)21(24)25/h3-12,23H,22H2,1-2H3,(H,24,25)