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

Systemtic Name: 4-[(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzenecarbonitrile Openeye Name: 4-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile CAS Name: 4-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile IUPAC Name: 4-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile Traditional Name: 4-[(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=C(C=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O/c18-13-5-8-15-16(2-1-9-21-17(15)10-13)20-14-6-3-12(11-19)4-7-14/h3-8,10,16,20H,1-2,9H2