11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid

Systemtic Name: 11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid Openeye Name: 11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid CAS Name: 11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepin-2-carboxylic acid IUPAC Name: 11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid Traditional Name: 11-methylsulfinyl-6,11-dihydrobenzo[c][1]benzoxepin-2-carboxylic acid Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1C2=CC=CC=C2COC3=C1C=C(C=C3)C(=O)O

Isomeric SMILES

CS(=O)C1C2=CC=CC=C2COC3=C1C=C(C=C3)C(=O)O

InChI

InChI=1S/C16H14O4S/c1-21(19)15-12-5-3-2-4-11(12)9-20-14-7-6-10(16(17)18)8-13(14)15/h2-8,15H,9H2,1H3,(H,17,18)