7-chloranyl-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one

Systemtic Name: 7-chloranyl-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one Openeye Name: 7-chloro-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one CAS Name: 7-chloro-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one IUPAC Name: 7-chloro-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one Traditional Name: 7-chloro-3,3-dimethyl-2,4-dihydro-1-benzoxepin-5-one Formula: C12H13ClO2 MolecularWeight: 224.68342

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=CC(=C2)Cl)OC1)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=CC(=C2)Cl)OC1)C

InChI

InChI=1S/C12H13ClO2/c1-12(2)6-10(14)9-5-8(13)3-4-11(9)15-7-12/h3-5H,6-7H2,1-2H3