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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC(C)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC(C)C4=CC=C(C=C4)CC

InChI

InChI=1S/C31H33ClN2O2/c1-5-7-18-36-25-14-12-24(13-15-25)29-19-27(26-16-17-28(32)20(3)30(26)34-29)31(35)33-21(4)23-10-8-22(6-2)9-11-23/h8-17,19,21H,5-7,18H2,1-4H3,(H,33,35)