5-bromanyl-2-pyridin-4-yl-3,4-dihydro-1,2,3-benzotriazepine

Systemtic Name: 5-bromanyl-2-pyridin-4-yl-3,4-dihydro-1,2,3-benzotriazepine Openeye Name: 5-bromo-2-(4-pyridyl)-3,4-dihydro-1,2,3-benzotriazepine CAS Name: 5-bromo-2-pyridin-4-yl-3,4-dihydro-1,2,3-benzotriazepine IUPAC Name: 5-bromo-2-pyridin-4-yl-3,4-dihydro-1,2,3-benzotriazepine Traditional Name: 5-bromo-2-(4-pyridyl)-3,4-dihydro-1,2,3-benzotriazepine Formula: C13H11BrN4 MolecularWeight: 303.15724

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C2C=CC=CC2=NN(N1)C3=CC=NC=C3)Br

Isomeric SMILES

C1C(=C2C=CC=CC2=NN(N1)C3=CC=NC=C3)Br

InChI

InChI=1S/C13H11BrN4/c14-12-9-16-18(10-5-7-15-8-6-10)17-13-4-2-1-3-11(12)13/h1-8,16H,9H2