N-[2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[2-[(3,4-dimethoxybenzoyl)amino]ethyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]ethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[2-[(3,4-dimethoxybenzoyl)amino]ethyl]-2-phenylquinoline-4-carboxamide Traditional Name: 2-phenyl-N-[2-(veratroylamino)ethyl]cinchoninamide Formula: C27H25N3O4 MolecularWeight: 455.5051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H25N3O4/c1-33-24-13-12-19(16-25(24)34-2)26(31)28-14-15-29-27(32)21-17-23(18-8-4-3-5-9-18)30-22-11-7-6-10-20(21)22/h3-13,16-17H,14-15H2,1-2H3,(H,28,31)(H,29,32)