[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 6-methyl-2-[4-(4-pentylcyclohexyl)phenyl]quinoline-4-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 6-methyl-2-[4-(4-pentylcyclohexyl)phenyl]quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 6-methyl-2-[4-(4-pentylcyclohexyl)phenyl]quinoline-4-carboxylate CAS Name: 6-methyl-2-[4-(4-pentylcyclohexyl)phenyl]-4-quinolinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 6-methyl-2-[4-(4-pentylcyclohexyl)phenyl]quinoline-4-carboxylate Traditional Name: 2-[4-(4-amylcyclohexyl)phenyl]-6-methyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C37H41NO4 MolecularWeight: 563.72574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)OCC(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)OCC(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C37H41NO4/c1-4-5-6-7-26-9-11-27(12-10-26)28-13-15-29(16-14-28)35-23-33(32-22-25(2)8-21-34(32)38-35)37(40)42-24-36(39)30-17-19-31(41-3)20-18-30/h8,13-23,26-27H,4-7,9-12,24H2,1-3H3