7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-8-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide

Systemtic Name: 7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-8-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide Openeye Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(3-isobutoxyphenyl)-8-methyl-quinoline-4-carboxamide CAS Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methyl-2-[3-(2-methylpropoxy)phenyl]-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methyl-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide Traditional Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(3-isobutoxyphenyl)-8-methyl-cinchoninamide Formula: C31H33ClN2O2 MolecularWeight: 501.05892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC(=CC=C4)OCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC(=CC=C4)OCC(C)C

InChI

InChI=1S/C31H33ClN2O2/c1-6-22-10-12-23(13-11-22)21(5)33-31(35)27-17-29(34-30-20(4)28(32)15-14-26(27)30)24-8-7-9-25(16-24)36-18-19(2)3/h7-17,19,21H,6,18H2,1-5H3,(H,33,35)