3-[3-(5-methoxy-1H-inden-2-yl)propanoyl]-4-sulfanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-[3-(5-methoxy-1H-inden-2-yl)propanoyl]-4-sulfanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 3-[3-(5-methoxy-1H-inden-2-yl)propanoyl]-4-thioxo-pyrrolidine-2-carboxylic acid CAS Name: 3-[3-(5-methoxy-1H-inden-2-yl)-1-oxopropyl]-4-sulfanylidene-2-pyrrolidinecarboxylic acid IUPAC Name: 3-[3-(5-methoxy-1H-inden-2-yl)propanoyl]-4-sulfanylidenepyrrolidine-2-carboxylic acid Traditional Name: 3-[3-(5-methoxy-1H-inden-2-yl)propanoyl]-4-thioxo-proline Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(=C2)CCC(=O)C3C(NCC3=S)C(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CC(=C2)CCC(=O)C3C(NCC3=S)C(=O)O)C=C1

InChI

InChI=1S/C18H19NO4S/c1-23-13-4-3-11-6-10(7-12(11)8-13)2-5-14(20)16-15(24)9-19-17(16)18(21)22/h3-4,7-8,16-17,19H,2,5-6,9H2,1H3,(H,21,22)