1-[(3Z)-3-(chloranylmethylidene)-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-7-yl]ethanone

Systemtic Name: 1-[(3Z)-3-(chloranylmethylidene)-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-7-yl]ethanone Openeye Name: 1-[(3Z)-5-benzyl-3-(chloromethylene)-4,5-dihydro-1-benzoxepin-7-yl]ethanone CAS Name: 1-[(3Z)-3-(chloromethylidene)-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-7-yl]ethanone IUPAC Name: 1-[(3Z)-5-benzyl-3-(chloromethylidene)-4,5-dihydro-1-benzoxepin-7-yl]ethanone Traditional Name: 1-[(3Z)-5-benzyl-3-(chloromethylene)-4,5-dihydro-1-benzoxepin-7-yl]ethanone Formula: C20H19ClO2 MolecularWeight: 326.81666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC/C(=C\Cl)/CC2CC3=CC=CC=C3

InChI

InChI=1S/C20H19ClO2/c1-14(22)17-7-8-20-19(11-17)18(10-16(12-21)13-23-20)9-15-5-3-2-4-6-15/h2-8,11-12,18H,9-10,13H2,1H3/b16-12-