2-[(1-methylindazol-7-yl)amino]-3-nitro-benzoic acid

Systemtic Name: 2-[(1-methylindazol-7-yl)amino]-3-nitro-benzoic acid Openeye Name: 2-[(1-methylindazol-7-yl)amino]-3-nitro-benzoic acid CAS Name: 2-[(1-methyl-7-indazolyl)amino]-3-nitrobenzoic acid IUPAC Name: 2-[(1-methylindazol-7-yl)amino]-3-nitrobenzoic acid Traditional Name: 2-[(1-methylindazol-7-yl)amino]-3-nitro-benzoic acid Formula: C15H12N4O4 MolecularWeight: 312.28018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2NC3=C(C=CC=C3[N+](=O)[O-])C(=O)O)C=N1

Isomeric SMILES

CN1C2=C(C=CC=C2NC3=C(C=CC=C3[N+](=O)[O-])C(=O)O)C=N1

InChI

InChI=1S/C15H12N4O4/c1-18-14-9(8-16-18)4-2-6-11(14)17-13-10(15(20)21)5-3-7-12(13)19(22)23/h2-8,17H,1H3,(H,20,21)