methyl 2-[(11Z)-11-(3-oxidanylpropylidene)-6H-benzo[c][1]benzoxepin-2-yl]ethanoate

Systemtic Name: methyl 2-[(11Z)-11-(3-oxidanylpropylidene)-6H-benzo[c][1]benzoxepin-2-yl]ethanoate Openeye Name: methyl 2-[(11Z)-11-(3-hydroxypropylidene)-6H-benzo[c][1]benzoxepin-2-yl]acetate CAS Name: 2-[(11Z)-11-(3-hydroxypropylidene)-6H-benzo[c][1]benzoxepin-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(11Z)-11-(3-hydroxypropylidene)-6H-benzo[c][1]benzoxepin-2-yl]acetate Traditional Name: 2-[(11Z)-11-(3-hydroxypropylidene)-6H-benzo[c][1]benzoxepin-2-yl]acetic acid methyl ester Formula: C20H20O4 MolecularWeight: 324.3704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1)OCC3=CC=CC=C3C2=CCCO

Isomeric SMILES

COC(=O)CC1=CC\2=C(C=C1)OCC3=CC=CC=C3/C2=C/CCO

InChI

InChI=1S/C20H20O4/c1-23-20(22)12-14-8-9-19-18(11-14)17(7-4-10-21)16-6-3-2-5-15(16)13-24-19/h2-3,5-9,11,21H,4,10,12-13H2,1H3/b17-7-