2-[4-methyl-2-(2,2,5,5-tetramethyl-1H-pyrrol-3-yl)-1,3-thiazol-5-yl]ethyl nitrate

Systemtic Name: 2-[4-methyl-2-(2,2,5,5-tetramethyl-1H-pyrrol-3-yl)-1,3-thiazol-5-yl]ethyl nitrate Openeye Name: 2-[4-methyl-2-(2,2,5,5-tetramethyl-1H-pyrrol-3-yl)thiazol-5-yl]ethyl nitrate CAS Name: nitric acid 2-[4-methyl-2-(2,2,5,5-tetramethyl-1H-pyrrol-3-yl)-5-thiazolyl]ethyl ester IUPAC Name: 2-[4-methyl-2-(2,2,5,5-tetramethyl-1H-pyrrol-3-yl)-1,3-thiazol-5-yl]ethyl nitrate Traditional Name: nitric acid 2-[4-methyl-2-(2,2,5,5-tetramethyl-3-pyrrolin-3-yl)thiazol-5-yl]ethyl ester Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(NC2(C)C)(C)C)CCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(NC2(C)C)(C)C)CCO[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O3S/c1-9-11(6-7-20-17(18)19)21-12(15-9)10-8-13(2,3)16-14(10,4)5/h8,16H,6-7H2,1-5H3