[2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [2-(5-nitro-1-naphthyl)-2-oxo-ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(5-nitro-1-naphthalenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-nitronaphthalen-1-yl)-2-oxoethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-keto-2-(5-nitro-1-naphthyl)ethyl] ester Formula: C23H16N2O5 MolecularWeight: 400.38354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC=CC4=C3C=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC=CC4=C3C=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O5/c1-14-12-19(16-6-2-3-10-20(16)24-14)23(27)30-13-22(26)18-9-4-8-17-15(18)7-5-11-21(17)25(28)29/h2-12H,13H2,1H3