N-cyclobutyl-4-methyl-3-(7-oxidanyl-1-oxidanylidene-isoquinolin-2-yl)benzamide

Systemtic Name: N-cyclobutyl-4-methyl-3-(7-oxidanyl-1-oxidanylidene-isoquinolin-2-yl)benzamide Openeye Name: N-cyclobutyl-3-(7-hydroxy-1-oxo-2-isoquinolyl)-4-methyl-benzamide CAS Name: N-cyclobutyl-3-(7-hydroxy-1-oxo-2-isoquinolinyl)-4-methylbenzamide IUPAC Name: N-cyclobutyl-3-(7-hydroxy-1-oxoisoquinolin-2-yl)-4-methylbenzamide Traditional Name: N-cyclobutyl-3-(7-hydroxy-1-keto-2-isoquinolyl)-4-methyl-benzamide Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCC2)N3C=CC4=C(C3=O)C=C(C=C4)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CCC2)N3C=CC4=C(C3=O)C=C(C=C4)O

InChI

InChI=1S/C21H20N2O3/c1-13-5-6-15(20(25)22-16-3-2-4-16)11-19(13)23-10-9-14-7-8-17(24)12-18(14)21(23)26/h5-12,16,24H,2-4H2,1H3,(H,22,25)