4-phenyl-2-propan-2-yl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride

Systemtic Name: 4-phenyl-2-propan-2-yl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride Openeye Name: 2-isopropyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride CAS Name: 4-phenyl-2-propan-2-yl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride IUPAC Name: 4-phenyl-2-propan-2-yl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride Traditional Name: 2-isopropyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine hydrochloride Formula: C17H20ClN3 MolecularWeight: 301.8138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2CN(N1)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2CN(N1)C3=CC=CC=C3.Cl

InChI

InChI=1S/C17H19N3.ClH/c1-13(2)17-18-16-11-7-6-8-14(16)12-20(19-17)15-9-4-3-5-10-15;/h3-11,13H,12H2,1-2H3,(H,18,19);1H