2-(benzotriazol-1-ylmethyl)-7-bromanyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(benzotriazol-1-ylmethyl)-7-bromanyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzotriazol-1-ylmethyl)-7-bromo-3,4-dihydro-1H-isoquinoline CAS Name: 2-(1-benzotriazolylmethyl)-7-bromo-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzotriazol-1-ylmethyl)-7-bromo-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(benzotriazol-1-ylmethyl)-7-bromo-3,4-dihydro-1H-isoquinoline Formula: C16H15BrN4 MolecularWeight: 343.2211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)Br)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)Br)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H15BrN4/c17-14-6-5-12-7-8-20(10-13(12)9-14)11-21-16-4-2-1-3-15(16)18-19-21/h1-6,9H,7-8,10-11H2