8-bromanyl-N-(1-imidazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 8-bromanyl-N-(1-imidazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 8-bromo-N-(2-imidazol-1-yl-1-methyl-ethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 8-bromo-N-[1-(1-imidazolyl)propan-2-yl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 8-bromo-N-(1-imidazol-1-ylpropan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(2-imidazol-1-yl-1-methyl-ethyl)amine Formula: C16H20BrN3O MolecularWeight: 350.2535

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CN=C1)NC2CCCOC3=C2C=CC(=C3)Br

Isomeric SMILES

CC(CN1C=CN=C1)NC2CCCOC3=C2C=CC(=C3)Br

InChI

InChI=1S/C16H20BrN3O/c1-12(10-20-7-6-18-11-20)19-15-3-2-8-21-16-9-13(17)4-5-14(15)16/h4-7,9,11-12,15,19H,2-3,8,10H2,1H3