6-deuterio-2-(phenylmethyl)-3,4-dihydro-2H-oxepin-7-one

Systemtic Name: 6-deuterio-2-(phenylmethyl)-3,4-dihydro-2H-oxepin-7-one Openeye Name: 2-benzyl-6-deuterio-3,4-dihydro-2H-oxepin-7-one CAS Name: 6-deuterio-2-(phenylmethyl)-3,4-dihydro-2H-oxepin-7-one IUPAC Name: 2-benzyl-6-deuterio-3,4-dihydro-2H-oxepin-7-one Traditional Name: 2-benzyl-6-deuterio-3,4-dihydro-2H-oxepin-7-one Formula: C13H14O2 MolecularWeight: 203.255222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC(=O)C=C1)CC2=CC=CC=C2

Isomeric SMILES

[2H]C1=CCCC(OC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C13H14O2/c14-13-9-5-4-8-12(15-13)10-11-6-2-1-3-7-11/h1-3,5-7,9,12H,4,8,10H2/i9D