2-oxidanylidene-2-(5-propylsulfanyl-1H-pyrrol-2-yl)ethanoic acid

Systemtic Name: 2-oxidanylidene-2-(5-propylsulfanyl-1H-pyrrol-2-yl)ethanoic acid Openeye Name: 2-oxo-2-(5-propylsulfanyl-1H-pyrrol-2-yl)acetic acid CAS Name: 2-oxo-2-[5-(propylthio)-1H-pyrrol-2-yl]acetic acid IUPAC Name: 2-oxo-2-(5-propylsulfanyl-1H-pyrrol-2-yl)acetic acid Traditional Name: 2-keto-2-[5-(propylthio)-1H-pyrrol-2-yl]acetic acid Formula: C9H11NO3S MolecularWeight: 213.25354

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=C(N1)C(=O)C(=O)O

Isomeric SMILES

CCCSC1=CC=C(N1)C(=O)C(=O)O

InChI

InChI=1S/C9H11NO3S/c1-2-5-14-7-4-3-6(10-7)8(11)9(12)13/h3-4,10H,2,5H2,1H3,(H,12,13)