2-(1-ethanoyliminopyrrolidin-1-ium-3-yl)sulfanylethylcarbamic acid

Systemtic Name: 2-(1-ethanoyliminopyrrolidin-1-ium-3-yl)sulfanylethylcarbamic acid Openeye Name: 2-(1-acetyliminopyrrolidin-1-ium-3-yl)sulfanylethylcarbamic acid CAS Name: 2-[(1-acetylimino-3-pyrrolidin-1-iumyl)thio]ethylcarbamic acid IUPAC Name: 2-(1-acetyliminopyrrolidin-1-ium-3-yl)sulfanylethylcarbamic acid Traditional Name: 2-[(1-acetyliminopyrrolidin-1-ium-3-yl)thio]ethylcarbamic acid Formula: C9H16N3O3S+ MolecularWeight: 246.30664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=[N+]1CCC(C1)SCCNC(=O)O

Isomeric SMILES

CC(=O)N=[N+]1CCC(C1)SCCNC(=O)O

InChI

InChI=1S/C9H15N3O3S/c1-7(13)11-12-4-2-8(6-12)16-5-3-10-9(14)15/h8,10H,2-6H2,1H3/p+1