ethyl (5E)-2-methyl-5-(1-methyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylate

Systemtic Name: ethyl (5E)-2-methyl-5-(1-methyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylate Openeye Name: ethyl (5E)-2-methyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylate CAS Name: (5E)-2-methyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2-methyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylate Traditional Name: (5E)-2-methyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(3-nitrophenyl)-6-phenyl-4H-pyridine-3-carboxylic acid ethyl ester Formula: C23H22N6O4 MolecularWeight: 446.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C2N=NNN2C)C1C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(/C(=C\2/N=NNN2C)/C1C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C

InChI

InChI=1S/C23H22N6O4/c1-4-33-23(30)18-14(2)24-21(15-9-6-5-7-10-15)20(22-25-26-27-28(22)3)19(18)16-11-8-12-17(13-16)29(31)32/h5-13,19H,4H2,1-3H3,(H,25,27)/b22-20-