methyl 4-[(3-nitro-2-oxidanyl-phenyl)methylamino]benzoate

Systemtic Name: methyl 4-[(3-nitro-2-oxidanyl-phenyl)methylamino]benzoate Openeye Name: methyl 4-[(2-hydroxy-3-nitro-phenyl)methylamino]benzoate CAS Name: 4-[(2-hydroxy-3-nitrophenyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-hydroxy-3-nitrophenyl)methylamino]benzoate Traditional Name: 4-[(2-hydroxy-3-nitro-benzyl)amino]benzoic acid methyl ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NCC2=C(C(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NCC2=C(C(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H14N2O5/c1-22-15(19)10-5-7-12(8-6-10)16-9-11-3-2-4-13(14(11)18)17(20)21/h2-8,16,18H,9H2,1H3