3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]-N-cycloheptyl-propanamide

Systemtic Name: 3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]-N-cycloheptyl-propanamide Openeye Name: 3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)-N-cycloheptyl-propanamide CAS Name: 3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]-N-cycloheptylpropanamide IUPAC Name: 3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)-N-cycloheptylpropanamide Traditional Name: 3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)-N-cycloheptyl-propionamide Formula: C25H28ClN3O2 MolecularWeight: 437.96172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H28ClN3O2/c26-19-12-14-23-22(16-19)28-21(25(31)29(23)17-18-8-4-3-5-9-18)13-15-24(30)27-20-10-6-1-2-7-11-20/h3-5,8-9,12,14,16,20H,1-2,6-7,10-11,13,15,17H2,(H,27,30)