methyl (2S)-2-[2-(2,3-dihydro-1H-inden-5-yloxy)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[2-(2,3-dihydro-1H-inden-5-yloxy)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[(2-indan-5-yloxyacetyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-(2,3-dihydro-1H-inden-5-yloxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2-indan-5-yloxyacetyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)COC1=CC2=C(CCC2)C=C1

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)COC1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C17H23NO4S/c1-21-17(20)15(8-9-23-2)18-16(19)11-22-14-7-6-12-4-3-5-13(12)10-14/h6-7,10,15H,3-5,8-9,11H2,1-2H3,(H,18,19)/t15-/m0/s1