2-(6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl)sulfanylethanoic acid Openeye Name: 2-(6-ethoxyspiro[chromane-2,1'-cyclopentane]-4-yl)sulfanylacetic acid CAS Name: 2-[(6-ethoxy-4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclopentane]yl)thio]acetic acid IUPAC Name: 2-(6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl)sulfanylacetic acid Traditional Name: 2-[(6-ethoxyspiro[chroman-2,1'-cyclopentane]-4-yl)thio]acetic acid Formula: C17H22O4S MolecularWeight: 322.41918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC3(CCCC3)CC2SCC(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC3(CCCC3)CC2SCC(=O)O

InChI

InChI=1S/C17H22O4S/c1-2-20-12-5-6-14-13(9-12)15(22-11-16(18)19)10-17(21-14)7-3-4-8-17/h5-6,9,15H,2-4,7-8,10-11H2,1H3,(H,18,19)