N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,4-dimethylphenyl)cinchoninamide Formula: C27H24N2O3 MolecularWeight: 424.49106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4COC5=CC=CC=C5O4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4COC5=CC=CC=C5O4)C

InChI

InChI=1S/C27H24N2O3/c1-17-11-12-19(13-18(17)2)24-14-22(21-7-3-4-8-23(21)29-24)27(30)28-15-20-16-31-25-9-5-6-10-26(25)32-20/h3-14,20H,15-16H2,1-2H3,(H,28,30)