2-(11-oxidanylidene-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)ethanoic acid

Systemtic Name: 2-(11-oxidanylidene-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)ethanoic acid Openeye Name: 2-(11-oxo-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)acetic acid CAS Name: 2-(11-oxo-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)acetic acid IUPAC Name: 2-(11-oxo-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)acetic acid Traditional Name: 2-(11-keto-6a,7,10,10a-tetrahydro-6H-benzo[c][1]benzoxepin-3-yl)acetic acid Formula: C16H16O4 MolecularWeight: 272.29584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1COC3=C(C2=O)C=CC(=C3)CC(=O)O

Isomeric SMILES

C1C=CCC2C1COC3=C(C2=O)C=CC(=C3)CC(=O)O

InChI

InChI=1S/C16H16O4/c17-15(18)8-10-5-6-13-14(7-10)20-9-11-3-1-2-4-12(11)16(13)19/h1-2,5-7,11-12H,3-4,8-9H2,(H,17,18)