methyl 4-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-nitro-benzoate

Systemtic Name: methyl 4-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-nitro-benzoate Openeye Name: methyl 4-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-nitro-benzoate CAS Name: 4-(2-imidazo[1,2-a]pyridinylmethylamino)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-nitrobenzoate Traditional Name: 4-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-nitro-benzoic acid methyl ester Formula: C16H14N4O4 MolecularWeight: 326.30676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NCC2=CN3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NCC2=CN3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4/c1-24-16(21)11-5-6-13(14(8-11)20(22)23)17-9-12-10-19-7-3-2-4-15(19)18-12/h2-8,10,17H,9H2,1H3