2-[[5-(3-nitrophenyl)-2-oxidanylidene-1,3-thiazolidin-4-yl]carbonylamino]ethyl nitrate

Systemtic Name: 2-[[5-(3-nitrophenyl)-2-oxidanylidene-1,3-thiazolidin-4-yl]carbonylamino]ethyl nitrate Openeye Name: 2-[[5-(3-nitrophenyl)-2-oxo-thiazolidine-4-carbonyl]amino]ethyl nitrate CAS Name: nitric acid 2-[[[5-(3-nitrophenyl)-2-oxo-4-thiazolidinyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[5-(3-nitrophenyl)-2-oxo-1,3-thiazolidine-4-carbonyl]amino]ethyl nitrate Traditional Name: nitric acid 2-[[2-keto-5-(3-nitrophenyl)thiazolidine-4-carbonyl]amino]ethyl ester Formula: C12H12N4O7S MolecularWeight: 356.31128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(NC(=O)S2)C(=O)NCCO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(NC(=O)S2)C(=O)NCCO[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O7S/c17-11(13-4-5-23-16(21)22)9-10(24-12(18)14-9)7-2-1-3-8(6-7)15(19)20/h1-3,6,9-10H,4-5H2,(H,13,17)(H,14,18)