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

Systemtic Name: 3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]-N-(4-methylphenyl)propanamide Openeye Name: 3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)-N-(p-tolyl)propanamide CAS Name: 3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]-N-(4-methylphenyl)propanamide IUPAC Name: 3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)-N-(4-methylphenyl)propanamide Traditional Name: 3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)-N-(p-tolyl)propionamide Formula: C25H22ClN3O2 MolecularWeight: 431.91408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC2=NC3=C(C=CC(=C3)Cl)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H22ClN3O2/c1-17-7-10-20(11-8-17)27-24(30)14-12-21-25(31)29(16-18-5-3-2-4-6-18)23-13-9-19(26)15-22(23)28-21/h2-11,13,15H,12,14,16H2,1H3,(H,27,30)