methyl 6-[(4-tert-butylphenyl)amino]-5-nitro-pyridine-3-carboxylate

Systemtic Name: methyl 6-[(4-tert-butylphenyl)amino]-5-nitro-pyridine-3-carboxylate Openeye Name: methyl 6-(4-tert-butylanilino)-5-nitro-pyridine-3-carboxylate CAS Name: 6-(4-tert-butylanilino)-5-nitro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-tert-butylanilino)-5-nitropyridine-3-carboxylate Traditional Name: 6-(4-tert-butylanilino)-5-nitro-nicotinic acid methyl ester Formula: C17H19N3O4 MolecularWeight: 329.35046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=C(C=C(C=N2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=C(C=C(C=N2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4/c1-17(2,3)12-5-7-13(8-6-12)19-15-14(20(22)23)9-11(10-18-15)16(21)24-4/h5-10H,1-4H3,(H,18,19)