3-sulfanylpropyl 2-(2,3-dihydro-1H-inden-2-ylcarbonylamino)-3-oxidanyl-butanoate

Systemtic Name: 3-sulfanylpropyl 2-(2,3-dihydro-1H-inden-2-ylcarbonylamino)-3-oxidanyl-butanoate Openeye Name: 3-sulfanylpropyl 3-hydroxy-2-(indane-2-carbonylamino)butanoate CAS Name: 2-[[2,3-dihydro-1H-inden-2-yl(oxo)methyl]amino]-3-hydroxybutanoic acid 3-mercaptopropyl ester IUPAC Name: 3-sulfanylpropyl 2-(2,3-dihydro-1H-indene-2-carbonylamino)-3-hydroxybutanoate Traditional Name: 3-hydroxy-2-(indane-2-carbonylamino)butyric acid 3-mercaptopropyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OCCCS)NC(=O)C1CC2=CC=CC=C2C1)O

Isomeric SMILES

CC(C(C(=O)OCCCS)NC(=O)C1CC2=CC=CC=C2C1)O

InChI

InChI=1S/C17H23NO4S/c1-11(19)15(17(21)22-7-4-8-23)18-16(20)14-9-12-5-2-3-6-13(12)10-14/h2-3,5-6,11,14-15,19,23H,4,7-10H2,1H3,(H,18,20)