2-(7-bromanyl-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine

Systemtic Name: 2-(7-bromanyl-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine Openeye Name: 2-(7-bromo-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine CAS Name: 2-(7-bromo-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine IUPAC Name: 2-(7-bromo-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine Traditional Name: 2-(7-bromo-5-methoxy-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-yl)pyridine Formula: C18H20BrNO2 MolecularWeight: 362.2609

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C=CC(=C2)Br)OC1)(C3=CC=CC=N3)OC)C

Isomeric SMILES

CC1(CC(C2=C(C=CC(=C2)Br)OC1)(C3=CC=CC=N3)OC)C

InChI

InChI=1S/C18H20BrNO2/c1-17(2)11-18(21-3,16-6-4-5-9-20-16)14-10-13(19)7-8-15(14)22-12-17/h4-10H,11-12H2,1-3H3