3-[2-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindol-1-yl]propanethioic S-acid

Systemtic Name: 3-[2-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindol-1-yl]propanethioic S-acid Openeye Name: 3-(2-tert-butoxycarbonylindolin-1-yl)propanethioic S-acid CAS Name: 3-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-2,3-dihydroindol-1-yl]propanethioic S-acid IUPAC Name: 3-[2-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindol-1-yl]propanethioic S-acid Traditional Name: 3-(2-tert-butoxycarbonylindolin-1-yl)thiopropionic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC2=CC=CC=C2N1CCC(=O)S

Isomeric SMILES

CC(C)(C)OC(=O)C1CC2=CC=CC=C2N1CCC(=O)S

InChI

InChI=1S/C16H21NO3S/c1-16(2,3)20-15(19)13-10-11-6-4-5-7-12(11)17(13)9-8-14(18)21/h4-7,13H,8-10H2,1-3H3,(H,18,21)