2-methoxy-5-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]benzoic acid

Systemtic Name: 2-methoxy-5-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]benzoic acid Openeye Name: 2-methoxy-5-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]benzoic acid CAS Name: 2-methoxy-5-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]benzoic acid IUPAC Name: 2-methoxy-5-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]benzoic acid Traditional Name: 5-[m-anisyl-(4-nitrobenzyl)amino]-2-methoxy-benzoic acid Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC(=CC=C3)OC)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC(=CC=C3)OC)C(=O)O

InChI

InChI=1S/C23H22N2O6/c1-30-20-5-3-4-17(12-20)15-24(14-16-6-8-18(9-7-16)25(28)29)19-10-11-22(31-2)21(13-19)23(26)27/h3-13H,14-15H2,1-2H3,(H,26,27)