3-(7-bromanyl-1-oxidanylidene-isoquinolin-2-yl)-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-(7-bromanyl-1-oxidanylidene-isoquinolin-2-yl)-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-(7-bromo-1-oxo-2-isoquinolyl)-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-(7-bromo-1-oxo-2-isoquinolinyl)-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-(7-bromo-1-oxoisoquinolin-2-yl)-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-(7-bromo-1-keto-2-isoquinolyl)-N-cyclopropyl-4-methyl-benzamide Formula: C20H17BrN2O2 MolecularWeight: 397.26518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C20H17BrN2O2/c1-12-2-3-14(19(24)22-16-6-7-16)10-18(12)23-9-8-13-4-5-15(21)11-17(13)20(23)25/h2-5,8-11,16H,6-7H2,1H3,(H,22,24)