methyl 4-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzoate

Systemtic Name: methyl 4-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzoate Openeye Name: methyl 4-(indan-5-ylsulfanylmethyl)benzoate CAS Name: 4-[(2,3-dihydro-1H-inden-5-ylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzoate Traditional Name: 4-[(indan-5-ylthio)methyl]benzoic acid methyl ester Formula: C18H18O2S MolecularWeight: 298.39932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C18H18O2S/c1-20-18(19)15-7-5-13(6-8-15)12-21-17-10-9-14-3-2-4-16(14)11-17/h5-11H,2-4,12H2,1H3