4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one

Systemtic Name: 4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one Openeye Name: 4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one CAS Name: 4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one IUPAC Name: 4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one Traditional Name: 4,7-dimethyl-4,5-dihydro-1-benzoxepin-3-one Formula: C12H14O2 MolecularWeight: 190.23836

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC(=C2)C)OCC1=O

Isomeric SMILES

CC1CC2=C(C=CC(=C2)C)OCC1=O

InChI

InChI=1S/C12H14O2/c1-8-3-4-12-10(5-8)6-9(2)11(13)7-14-12/h3-5,9H,6-7H2,1-2H3