dimethylcarbamothioic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: dimethylcarbamothioic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: dimethylcarbamothioic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: dimethylcarbamothioic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: dimethylcarbamothioic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: dimethylthiocarbamic S-acid; (6E)-6-(4-methoxy-1H-pyridin-2-ylidene)-4-nitro-cyclohexa-2,4-dien-1-one Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)S.COC1=CC(=C2C=C(C=CC2=O)[N+](=O)[O-])NC=C1

Isomeric SMILES

CN(C)C(=O)S.COC1=C/C(=C\2/C=C(C=CC2=O)[N+](=O)[O-])/NC=C1

InChI

InChI=1S/C12H10N2O4.C3H7NOS/c1-18-9-4-5-13-11(7-9)10-6-8(14(16)17)2-3-12(10)15;1-4(2)3(5)6/h2-7,13H,1H3;1-2H3,(H,5,6)/b11-10+;