[nitro(phenyl)methyl] 2-aminocarbonyl-5-sulfanyl-piperidine-1-carboxylate

Systemtic Name: [nitro(phenyl)methyl] 2-aminocarbonyl-5-sulfanyl-piperidine-1-carboxylate Openeye Name: [nitro(phenyl)methyl] 2-carbamoyl-5-sulfanyl-piperidine-1-carboxylate CAS Name: 2-carbamoyl-5-mercapto-1-piperidinecarboxylic acid [nitro(phenyl)methyl] ester IUPAC Name: [nitro(phenyl)methyl] 2-carbamoyl-5-sulfanylpiperidine-1-carboxylate Traditional Name: 2-carbamoyl-5-mercapto-piperidine-1-carboxylic acid [nitro(phenyl)methyl] ester Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(CC1S)C(=O)OC(C2=CC=CC=C2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CC(N(CC1S)C(=O)OC(C2=CC=CC=C2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C14H17N3O5S/c15-12(18)11-7-6-10(23)8-16(11)14(19)22-13(17(20)21)9-4-2-1-3-5-9/h1-5,10-11,13,23H,6-8H2,(H2,15,18)