3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one

Systemtic Name: 3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one Openeye Name: 3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one CAS Name: 3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one IUPAC Name: 3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one Traditional Name: 3,3,7-trimethyl-2,4-dihydro-1-benzoxepin-5-one Formula: C13H16O2 MolecularWeight: 204.26494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(CC2=O)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(CC2=O)(C)C

InChI

InChI=1S/C13H16O2/c1-9-4-5-12-10(6-9)11(14)7-13(2,3)8-15-12/h4-6H,7-8H2,1-3H3