2-(benzotriazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(1-benzotriazolyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C17H16N4O MolecularWeight: 292.33514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H16N4O/c22-17(12-21-16-8-4-3-7-15(16)18-19-21)20-10-9-13-5-1-2-6-14(13)11-20/h1-8H,9-12H2