[2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 8-chloranyl-2-(4-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 8-chloranyl-2-(4-methoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxo-ethyl] 8-chloro-2-(4-methoxyphenyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-methoxyphenyl)-4-quinolinecarboxylic acid [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] 8-chloro-2-(4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(4-methoxyphenyl)cinchoninic acid [2-keto-2-[4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C31H21ClN2O7 MolecularWeight: 568.96064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H21ClN2O7/c1-39-22-11-5-19(6-12-22)28-17-26(25-3-2-4-27(32)30(25)33-28)31(36)40-18-29(35)20-7-13-23(14-8-20)41-24-15-9-21(10-16-24)34(37)38/h2-17H,18H2,1H3