2-[[3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]propanoic acid

Systemtic Name: 2-[[3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]propanoic acid Openeye Name: 2-[[2-ethoxy-1-(indan-2-ylsulfanylmethyl)-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[3-(2,3-dihydro-1H-inden-2-ylthio)-1-ethoxy-1-oxopropan-2-yl]amino]propanoic acid IUPAC Name: 2-[[3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-1-ethoxy-1-oxopropan-2-yl]amino]propanoic acid Traditional Name: 2-[[2-ethoxy-1-[(indan-2-ylthio)methyl]-2-keto-ethyl]amino]propionic acid Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC1CC2=CC=CC=C2C1)NC(C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CSC1CC2=CC=CC=C2C1)NC(C)C(=O)O

InChI

InChI=1S/C17H23NO4S/c1-3-22-17(21)15(18-11(2)16(19)20)10-23-14-8-12-6-4-5-7-13(12)9-14/h4-7,11,14-15,18H,3,8-10H2,1-2H3,(H,19,20)