S-[5-[[ethanoyl(nitro)amino]methyl]pyrrolidin-3-yl] ethanethioate

Systemtic Name: S-[5-[[ethanoyl(nitro)amino]methyl]pyrrolidin-3-yl] ethanethioate Openeye Name: S-[5-[[acetyl(nitro)amino]methyl]pyrrolidin-3-yl] ethanethioate CAS Name: ethanethioic acid S-[5-[[acetyl(nitro)amino]methyl]-3-pyrrolidinyl] ester IUPAC Name: S-[5-[[acetyl(nitro)amino]methyl]pyrrolidin-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[5-[[acetyl(nitro)amino]methyl]pyrrolidin-3-yl] ester Formula: C9H15N3O4S MolecularWeight: 261.2981

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1CC(CN1)SC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(CC1CC(CN1)SC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C9H15N3O4S/c1-6(13)11(12(15)16)5-8-3-9(4-10-8)17-7(2)14/h8-10H,3-5H2,1-2H3