5-[(2,5-dimethoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-methoxy-benzoic acid

Systemtic Name: 5-[(2,5-dimethoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-methoxy-benzoic acid Openeye Name: 5-[(2,5-dimethoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-methoxy-benzoic acid CAS Name: 5-[(2,5-dimethoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-methoxybenzoic acid IUPAC Name: 5-[(2,5-dimethoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-methoxybenzoic acid Traditional Name: 5-[(2,5-dimethoxybenzyl)-(4-nitrobenzyl)amino]-2-methoxy-benzoic acid Formula: C24H24N2O7 MolecularWeight: 452.45656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O7/c1-31-20-9-11-22(32-2)17(12-20)15-25(14-16-4-6-18(7-5-16)26(29)30)19-8-10-23(33-3)21(13-19)24(27)28/h4-13H,14-15H2,1-3H3,(H,27,28)