2,2,5,7-tetramethyl-6-(nitromethylsulfanyl)-3,4-dihydrochromene

Systemtic Name: 2,2,5,7-tetramethyl-6-(nitromethylsulfanyl)-3,4-dihydrochromene Openeye Name: 2,2,5,7-tetramethyl-6-(nitromethylsulfanyl)chromane CAS Name: 2,2,5,7-tetramethyl-6-(nitromethylthio)-3,4-dihydro-2H-1-benzopyran IUPAC Name: 2,2,5,7-tetramethyl-6-(nitromethylsulfanyl)-3,4-dihydrochromene Traditional Name: 2,2,5,7-tetramethyl-6-(nitromethylthio)chroman Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CCC(O2)(C)C)C(=C1SC[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(CCC(O2)(C)C)C(=C1SC[N+](=O)[O-])C

InChI

InChI=1S/C14H19NO3S/c1-9-7-12-11(5-6-14(3,4)18-12)10(2)13(9)19-8-15(16)17/h7H,5-6,8H2,1-4H3