(E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)but-3-en-2-one

Systemtic Name: (E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)but-3-en-2-one Openeye Name: (E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)but-3-en-2-one CAS Name: (E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)-3-buten-2-one IUPAC Name: (E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)but-3-en-2-one Traditional Name: (E)-4-(7-ethyl-3,3-dimethyl-2H-1-benzoxepin-5-yl)but-3-en-2-one Formula: C18H22O2 MolecularWeight: 270.36608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OCC(C=C2C=CC(=O)C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OCC(C=C2/C=C/C(=O)C)(C)C

InChI

InChI=1S/C18H22O2/c1-5-14-7-9-17-16(10-14)15(8-6-13(2)19)11-18(3,4)12-20-17/h6-11H,5,12H2,1-4H3/b8-6+