N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide Openeye Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide CAS Name: N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoxaline-2-carboxamide Traditional Name: N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)quinoxaline-2-carboxamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H22N4O2/c1-14(2)22(28)26-10-9-15-7-8-17(11-16(15)13-26)24-21(27)20-12-23-18-5-3-4-6-19(18)25-20/h3-8,11-12,14H,9-10,13H2,1-2H3,(H,24,27)