4-prop-2-enyl-1-(3-sulfanylpropanoyl)-2,5-dihydropyrrole-2-carboxylic acid

Systemtic Name: 4-prop-2-enyl-1-(3-sulfanylpropanoyl)-2,5-dihydropyrrole-2-carboxylic acid Openeye Name: 4-allyl-1-(3-sulfanylpropanoyl)-2,5-dihydropyrrole-2-carboxylic acid CAS Name: 1-(3-mercapto-1-oxopropyl)-4-prop-2-enyl-2,5-dihydropyrrole-2-carboxylic acid IUPAC Name: 4-prop-2-enyl-1-(3-sulfanylpropanoyl)-2,5-dihydropyrrole-2-carboxylic acid Traditional Name: 4-allyl-1-(3-mercaptopropanoyl)-3-pyrroline-2-carboxylic acid Formula: C11H15NO3S MolecularWeight: 241.3067

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC(N(C1)C(=O)CCS)C(=O)O

Isomeric SMILES

C=CCC1=CC(N(C1)C(=O)CCS)C(=O)O

InChI

InChI=1S/C11H15NO3S/c1-2-3-8-6-9(11(14)15)12(7-8)10(13)4-5-16/h2,6,9,16H,1,3-5,7H2,(H,14,15)