2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)ethanoic acid

Systemtic Name: 2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)ethanoic acid Openeye Name: 2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)acetic acid CAS Name: 2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)acetic acid IUPAC Name: 2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)acetic acid Traditional Name: 2-(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)acetic acid Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1SCC3=CC=CC=C3C2CC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1SCC3=CC=CC=C3C2CC(=O)O

InChI

InChI=1S/C17H16O3S/c1-20-15-8-4-7-13-14(9-16(18)19)12-6-3-2-5-11(12)10-21-17(13)15/h2-8,14H,9-10H2,1H3,(H,18,19)