5-(4-methylphenyl)-4,5-dihydro-1-benzoxepin-3-one

Systemtic Name: 5-(4-methylphenyl)-4,5-dihydro-1-benzoxepin-3-one Openeye Name: 5-(p-tolyl)-4,5-dihydro-1-benzoxepin-3-one CAS Name: 5-(4-methylphenyl)-4,5-dihydro-1-benzoxepin-3-one IUPAC Name: 5-(4-methylphenyl)-4,5-dihydro-1-benzoxepin-3-one Traditional Name: 5-(p-tolyl)-4,5-dihydro-1-benzoxepin-3-one Formula: C17H16O2 MolecularWeight: 252.30774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)COC3=CC=CC=C23

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)COC3=CC=CC=C23

InChI

InChI=1S/C17H16O2/c1-12-6-8-13(9-7-12)16-10-14(18)11-19-17-5-3-2-4-15(16)17/h2-9,16H,10-11H2,1H3