3-[(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanenitrile

Systemtic Name: 3-[(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanenitrile Openeye Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanenitrile CAS Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanenitrile IUPAC Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanenitrile Traditional Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propionitrile Formula: C13H15BrN2O MolecularWeight: 295.175

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C=C(C=C2)Br)OC1)NCCC#N

Isomeric SMILES

C1CC(C2=C(C=C(C=C2)Br)OC1)NCCC#N

InChI

InChI=1S/C13H15BrN2O/c14-10-4-5-11-12(16-7-2-6-15)3-1-8-17-13(11)9-10/h4-5,9,12,16H,1-3,7-8H2