2-[(4-azanyl-2-nitro-phenyl)amino]-5-methoxy-benzoic acid

Systemtic Name: 2-[(4-azanyl-2-nitro-phenyl)amino]-5-methoxy-benzoic acid Openeye Name: 2-(4-amino-2-nitro-anilino)-5-methoxy-benzoic acid CAS Name: 2-(4-amino-2-nitroanilino)-5-methoxybenzoic acid IUPAC Name: 2-(4-amino-2-nitroanilino)-5-methoxybenzoic acid Traditional Name: 2-(4-amino-2-nitro-anilino)-5-methoxy-benzoic acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=C(C=C(C=C2)N)[N+](=O)[O-])C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=C(C=C(C=C2)N)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H13N3O5/c1-22-9-3-5-11(10(7-9)14(18)19)16-12-4-2-8(15)6-13(12)17(20)21/h2-7,16H,15H2,1H3,(H,18,19)