[2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-chloro-3-nitro-phenyl)-2-oxo-ethyl] 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-6-methyl-4-quinolinecarboxylic acid [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-(4-methoxyphenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-6-methyl-cinchoninic acid [2-(4-chloro-3-nitro-phenyl)-2-keto-ethyl] ester Formula: C26H19ClN2O6 MolecularWeight: 490.89186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H19ClN2O6/c1-15-3-10-22-19(11-15)20(13-23(28-22)16-4-7-18(34-2)8-5-16)26(31)35-14-25(30)17-6-9-21(27)24(12-17)29(32)33/h3-13H,14H2,1-2H3