2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)ethanoic acid

Systemtic Name: 2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)ethanoic acid Openeye Name: 2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)acetic acid CAS Name: 2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)acetic acid IUPAC Name: 2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)acetic acid Traditional Name: 2-(7-ethyl-5,6-dihydrobenzo[b][1]benzoxepin-3-yl)acetic acid Formula: C18H18O3 MolecularWeight: 282.33372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCC3=C(C=CC(=C3)CC(=O)O)OC2=CC=C1

Isomeric SMILES

CCC1=C2CCC3=C(C=CC(=C3)CC(=O)O)OC2=CC=C1

InChI

InChI=1S/C18H18O3/c1-2-13-4-3-5-17-15(13)8-7-14-10-12(11-18(19)20)6-9-16(14)21-17/h3-6,9-10H,2,7-8,11H2,1H3,(H,19,20)