7-ethanoyl-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-3-one

Systemtic Name: 7-ethanoyl-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-3-one Openeye Name: 7-acetyl-5-benzyl-4,5-dihydro-1-benzoxepin-3-one CAS Name: 7-acetyl-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-3-one IUPAC Name: 7-acetyl-5-benzyl-4,5-dihydro-1-benzoxepin-3-one Traditional Name: 7-acetyl-5-benzyl-4,5-dihydro-1-benzoxepin-3-one Formula: C19H18O3 MolecularWeight: 294.34442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)CC2CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)CC2CC3=CC=CC=C3

InChI

InChI=1S/C19H18O3/c1-13(20)15-7-8-19-18(11-15)16(10-17(21)12-22-19)9-14-5-3-2-4-6-14/h2-8,11,16H,9-10,12H2,1H3