4-[(2-methylphenyl)methyl]-1-(2,6,8-trimethylquinolin-4-yl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(2-methylphenyl)methyl]-1-(2,6,8-trimethylquinolin-4-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-(o-tolylmethyl)-1-(2,6,8-trimethylquinoline-4-carbonyl)-1,4-diazepan-5-one CAS Name: 4-[(2-methylphenyl)methyl]-1-[oxo-(2,6,8-trimethyl-4-quinolinyl)methyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-methylphenyl)methyl]-1-(2,6,8-trimethylquinoline-4-carbonyl)-1,4-diazepan-5-one Traditional Name: 4-(2-methylbenzyl)-1-(2,6,8-trimethylquinoline-4-carbonyl)-1,4-diazepan-5-one Formula: C26H29N3O2 MolecularWeight: 415.52736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CCC2=O)C(=O)C3=CC(=NC4=C(C=C(C=C34)C)C)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CCC2=O)C(=O)C3=CC(=NC4=C(C=C(C=C34)C)C)C

InChI

InChI=1S/C26H29N3O2/c1-17-13-19(3)25-22(14-17)23(15-20(4)27-25)26(31)28-10-9-24(30)29(12-11-28)16-21-8-6-5-7-18(21)2/h5-8,13-15H,9-12,16H2,1-4H3