8-bromanyl-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 8-bromanyl-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 8-bromo-N-(3-pyridylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 8-bromo-N-(3-pyridinylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 8-bromo-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(3-pyridylmethyl)amine Formula: C16H17BrN2O MolecularWeight: 333.22298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C=C(C=C2)Br)OC1)NCC3=CN=CC=C3

Isomeric SMILES

C1CC(C2=C(C=C(C=C2)Br)OC1)NCC3=CN=CC=C3

InChI

InChI=1S/C16H17BrN2O/c17-13-5-6-14-15(4-2-8-20-16(14)9-13)19-11-12-3-1-7-18-10-12/h1,3,5-7,9-10,15,19H,2,4,8,11H2