1-[4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(benzothiophen-3-yl)-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[4-(1-benzothiophen-3-yl)-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(1-benzothiophen-3-yl)-4-oxobutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(benzothiophen-3-yl)-4-keto-butanoyl]proline Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(=O)C2=CSC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCC(=O)C2=CSC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H17NO4S/c19-14(12-10-23-15-6-2-1-4-11(12)15)7-8-16(20)18-9-3-5-13(18)17(21)22/h1-2,4,6,10,13H,3,5,7-9H2,(H,21,22)