2-(5-oxidanylidene-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)ethanoic acid

Systemtic Name: 2-(5-oxidanylidene-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)ethanoic acid Openeye Name: 2-(5-oxo-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)acetic acid CAS Name: 2-(5-oxo-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)acetic acid IUPAC Name: 2-(5-oxo-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)acetic acid Traditional Name: 2-(5-keto-6,11-dihydrobenzo[c][1]benzothiepin-2-yl)acetic acid Formula: C16H14O3S MolecularWeight: 286.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CS(=O)C3=C1C=C(C=C3)CC(=O)O

Isomeric SMILES

C1C2=CC=CC=C2CS(=O)C3=C1C=C(C=C3)CC(=O)O

InChI

InChI=1S/C16H14O3S/c17-16(18)8-11-5-6-15-14(7-11)9-12-3-1-2-4-13(12)10-20(15)19/h1-7H,8-10H2,(H,17,18)