3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-methylphenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-methylphenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl(o-tolyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-methylphenyl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-methylphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl(o-tolyl)methanone Formula: C17H16O3 MolecularWeight: 268.30714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H16O3/c1-12-5-2-3-6-14(12)17(18)13-7-8-15-16(11-13)20-10-4-9-19-15/h2-3,5-8,11H,4,9-10H2,1H3