[2-bromanyl-4-[(E)-2-cyano-3-[(2-nitrophenyl)amino]-3-oxidanylidene-prop-1-enyl]-6-methoxy-phenyl] naphthalene-1-carboxylate

Systemtic Name: [2-bromanyl-4-[(E)-2-cyano-3-[(2-nitrophenyl)amino]-3-oxidanylidene-prop-1-enyl]-6-methoxy-phenyl] naphthalene-1-carboxylate Openeye Name: [2-bromo-4-[(E)-2-cyano-3-(2-nitroanilino)-3-oxo-prop-1-enyl]-6-methoxy-phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [2-bromo-4-[(E)-2-cyano-3-(2-nitroanilino)-3-oxoprop-1-enyl]-6-methoxyphenyl] ester IUPAC Name: [2-bromo-4-[(E)-2-cyano-3-(2-nitroanilino)-3-oxoprop-1-enyl]-6-methoxyphenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [2-bromo-4-[(E)-2-cyano-3-keto-3-(2-nitroanilino)prop-1-enyl]-6-methoxy-phenyl] ester Formula: C28H18BrN3O6 MolecularWeight: 572.36302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2[N+](=O)[O-])Br)OC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2[N+](=O)[O-])Br)OC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H18BrN3O6/c1-37-25-15-17(13-19(16-30)27(33)31-23-11-4-5-12-24(23)32(35)36)14-22(29)26(25)38-28(34)21-10-6-8-18-7-2-3-9-20(18)21/h2-15H,1H3,(H,31,33)/b19-13+