3-(7-bromanyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine

Systemtic Name: 3-(7-bromanyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine Openeye Name: 3-(7-bromo-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine CAS Name: 3-(7-bromo-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine IUPAC Name: 3-(7-bromo-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine Traditional Name: 3-(7-bromo-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine Formula: C17H16BrNO MolecularWeight: 330.21904

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)Br)C(=C1)C3=CN=CC=C3)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)Br)C(=C1)C3=CN=CC=C3)C

InChI

InChI=1S/C17H16BrNO/c1-17(2)9-15(12-4-3-7-19-10-12)14-8-13(18)5-6-16(14)20-11-17/h3-10H,11H2,1-2H3