2-(1,3-benzodioxol-5-yl)-7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methyl-quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methyl-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methylquinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-N-[1-(4-ethylphenyl)ethyl]-8-methyl-cinchoninamide Formula: C28H25ClN2O3 MolecularWeight: 472.9627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H25ClN2O3/c1-4-18-5-7-19(8-6-18)17(3)30-28(32)22-14-24(20-9-12-25-26(13-20)34-15-33-25)31-27-16(2)23(29)11-10-21(22)27/h5-14,17H,4,15H2,1-3H3,(H,30,32)