6-sulfanylidene-1-(2,2,3-trimethyl-6-nitro-3-oxidanyl-4H-chromen-4-yl)-2H-pyridin-5-one

Systemtic Name: 6-sulfanylidene-1-(2,2,3-trimethyl-6-nitro-3-oxidanyl-4H-chromen-4-yl)-2H-pyridin-5-one Openeye Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-chroman-4-yl)-6-thioxo-2H-pyridin-5-one CAS Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-6-sulfanylidene-2H-pyridin-5-one IUPAC Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-4H-chromen-4-yl)-6-sulfanylidene-2H-pyridin-5-one Traditional Name: 1-(3-hydroxy-2,2,3-trimethyl-6-nitro-chroman-4-yl)-6-thioxo-2H-pyridin-5-one Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC=CC(=O)C3=S)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CC=CC(=O)C3=S)(C)O)C

InChI

InChI=1S/C17H18N2O5S/c1-16(2)17(3,21)14(18-8-4-5-12(20)15(18)25)11-9-10(19(22)23)6-7-13(11)24-16/h4-7,9,14,21H,8H2,1-3H3