3-[7-chloranyl-4-(2-methylpropyl)-3-oxidanylidene-quinoxalin-2-yl]-N-(3-chlorophenyl)propanamide

Systemtic Name: 3-[7-chloranyl-4-(2-methylpropyl)-3-oxidanylidene-quinoxalin-2-yl]-N-(3-chlorophenyl)propanamide Openeye Name: 3-(7-chloro-4-isobutyl-3-oxo-quinoxalin-2-yl)-N-(3-chlorophenyl)propanamide CAS Name: 3-[7-chloro-4-(2-methylpropyl)-3-oxo-2-quinoxalinyl]-N-(3-chlorophenyl)propanamide IUPAC Name: 3-[7-chloro-4-(2-methylpropyl)-3-oxoquinoxalin-2-yl]-N-(3-chlorophenyl)propanamide Traditional Name: 3-(7-chloro-4-isobutyl-3-keto-quinoxalin-2-yl)-N-(3-chlorophenyl)propionamide Formula: C21H21Cl2N3O2 MolecularWeight: 418.31634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C(C1=O)CCC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C(C1=O)CCC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21Cl2N3O2/c1-13(2)12-26-19-8-6-15(23)11-18(19)25-17(21(26)28)7-9-20(27)24-16-5-3-4-14(22)10-16/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,24,27)