8-bromanyl-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine

Systemtic Name: 8-bromanyl-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine Openeye Name: 8-bromo-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine CAS Name: 8-bromo-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine IUPAC Name: 8-bromo-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine Traditional Name: 8-bromo-2-butyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine Formula: C18H20BrN3 MolecularWeight: 358.2755

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(CN(N1)C3=CC=CC=C3)C=CC(=C2)Br

Isomeric SMILES

CCCCC1=NC2=C(CN(N1)C3=CC=CC=C3)C=CC(=C2)Br

InChI

InChI=1S/C18H20BrN3/c1-2-3-9-18-20-17-12-15(19)11-10-14(17)13-22(21-18)16-7-5-4-6-8-16/h4-8,10-12H,2-3,9,13H2,1H3,(H,20,21)