N1-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-N2,N2,3-trimethyl-butane-1,2-diamine

Systemtic Name: N1-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-N2,N2,3-trimethyl-butane-1,2-diamine Openeye Name: N1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-N2,N2,3-trimethyl-butane-1,2-diamine CAS Name: N1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-N2,N2,3-trimethylbutane-1,2-diamine IUPAC Name: 1-N-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-2-N,2-N,3-trimethylbutane-1,2-diamine Traditional Name: [1-[[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]methyl]-2-methyl-propyl]-dimethyl-amine Formula: C17H27BrN2O MolecularWeight: 355.31308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1CCCOC2=C1C=CC(=C2)Br)N(C)C

Isomeric SMILES

CC(C)C(CNC1CCCOC2=C1C=CC(=C2)Br)N(C)C

InChI

InChI=1S/C17H27BrN2O/c1-12(2)16(20(3)4)11-19-15-6-5-9-21-17-10-13(18)7-8-14(15)17/h7-8,10,12,15-16,19H,5-6,9,11H2,1-4H3