methyl 2-(1H-indazol-4-ylamino)-3-nitro-benzoate

Systemtic Name: methyl 2-(1H-indazol-4-ylamino)-3-nitro-benzoate Openeye Name: methyl 2-(1H-indazol-4-ylamino)-3-nitro-benzoate CAS Name: 2-(1H-indazol-4-ylamino)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(1H-indazol-4-ylamino)-3-nitrobenzoate Traditional Name: 2-(1H-indazol-4-ylamino)-3-nitro-benzoic acid methyl ester Formula: C15H12N4O4 MolecularWeight: 312.28018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])NC2=CC=CC3=C2C=NN3

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])NC2=CC=CC3=C2C=NN3

InChI

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