2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-1-yl)propanoic acid

Systemtic Name: 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-1-yl)propanoic acid Openeye Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-1-yl)propanoic acid CAS Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-1-yl)propanoic acid IUPAC Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-1-yl)propanoic acid Traditional Name: 2-(5-keto-6H-benzo[b][1]benzoxepin-1-yl)propionic acid Formula: C17H14O4 MolecularWeight: 282.29066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=C1OC3=CC=CC=C3CC2=O)C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=C1OC3=CC=CC=C3CC2=O)C(=O)O

InChI

InChI=1S/C17H14O4/c1-10(17(19)20)12-6-4-7-13-14(18)9-11-5-2-3-8-15(11)21-16(12)13/h2-8,10H,9H2,1H3,(H,19,20)