6-(cyclopropylmethylsulfanyl)-3,4-dihydro-2H-chromene-8-carboxylic acid

Systemtic Name: 6-(cyclopropylmethylsulfanyl)-3,4-dihydro-2H-chromene-8-carboxylic acid Openeye Name: 6-(cyclopropylmethylsulfanyl)chromane-8-carboxylic acid CAS Name: 6-(cyclopropylmethylthio)-3,4-dihydro-2H-1-benzopyran-8-carboxylic acid IUPAC Name: 6-(cyclopropylmethylsulfanyl)-3,4-dihydro-2H-chromene-8-carboxylic acid Traditional Name: 6-(cyclopropylmethylthio)chroman-8-carboxylic acid Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC(=C2)SCC3CC3)C(=O)O)OC1

Isomeric SMILES

C1CC2=C(C(=CC(=C2)SCC3CC3)C(=O)O)OC1

InChI

InChI=1S/C14H16O3S/c15-14(16)12-7-11(18-8-9-3-4-9)6-10-2-1-5-17-13(10)12/h6-7,9H,1-5,8H2,(H,15,16)