2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: 2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: 2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: 2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: 2H-benzotriazol-5-yl(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C16H14N4O MolecularWeight: 278.30856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C16H14N4O/c21-16(12-5-6-14-15(9-12)18-19-17-14)20-8-7-11-3-1-2-4-13(11)10-20/h1-6,9H,7-8,10H2,(H,17,18,19)