4-nitrooxybutyl 3-pyridin-3-ylcarbonyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 4-nitrooxybutyl 3-pyridin-3-ylcarbonyl-1,3-thiazolidine-4-carboxylate Openeye Name: 4-nitrooxybutyl 3-(pyridine-3-carbonyl)thiazolidine-4-carboxylate CAS Name: 3-[oxo(3-pyridinyl)methyl]-4-thiazolidinecarboxylic acid 4-nitrooxybutyl ester IUPAC Name: 4-nitrooxybutyl 3-(pyridine-3-carbonyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-nicotinoylthiazolidine-4-carboxylic acid 4-nitrooxybutyl ester Formula: C14H17N3O6S MolecularWeight: 355.36628

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CS1)C(=O)C2=CN=CC=C2)C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

C1C(N(CS1)C(=O)C2=CN=CC=C2)C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6S/c18-13(11-4-3-5-15-8-11)16-10-24-9-12(16)14(19)22-6-1-2-7-23-17(20)21/h3-5,8,12H,1-2,6-7,9-10H2