N-[4-(2-methylpropanoylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(2-methylpropanoylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(2-methylpropanoylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(isobutyrylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C29H29N3O5 MolecularWeight: 499.55766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C29H29N3O5/c1-17(2)28(33)30-19-10-12-20(13-11-19)31-29(34)22-16-24(32-23-9-7-6-8-21(22)23)18-14-25(35-3)27(37-5)26(15-18)36-4/h6-17H,1-5H3,(H,30,33)(H,31,34)