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

Systemtic Name: 3-[(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzenecarbonitrile Openeye Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile CAS Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile IUPAC Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile Traditional Name: 3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile Formula: C17H15BrN2O MolecularWeight: 343.2178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C=C(C=C2)Br)OC1)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CC(C2=C(C=C(C=C2)Br)OC1)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H15BrN2O/c18-13-6-7-15-16(5-2-8-21-17(15)10-13)20-14-4-1-3-12(9-14)11-19/h1,3-4,6-7,9-10,16,20H,2,5,8H2