4-[(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)oxy]-1H-pyridine-2-thione

Systemtic Name: 4-[(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)oxy]-1H-pyridine-2-thione Openeye Name: 4-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)oxy-1H-pyridine-2-thione CAS Name: 4-[(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-1H-pyridine-2-thione IUPAC Name: 4-[(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)oxy]-1H-pyridine-2-thione Traditional Name: 4-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)oxy-1H-pyridine-2-thione Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])OC3=CC(=S)NC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])OC3=CC(=S)NC=C3)O)C

InChI

InChI=1S/C16H16N2O5S/c1-16(2)15(19)14(22-10-5-6-17-13(24)8-10)11-7-9(18(20)21)3-4-12(11)23-16/h3-8,14-15,19H,1-2H3,(H,17,24)