(2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(4-methylsulfonyl-1,3-benzodioxol-5-yl)propane-1,3-dione

Systemtic Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(4-methylsulfonyl-1,3-benzodioxol-5-yl)propane-1,3-dione Openeye Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylene)-3-(4-methylsulfonyl-1,3-benzodioxol-5-yl)propane-1,3-dione CAS Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(4-methylsulfonyl-1,3-benzodioxol-5-yl)propane-1,3-dione IUPAC Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylidene)-3-(4-methylsulfonyl-1,3-benzodioxol-5-yl)propane-1,3-dione Traditional Name: (2E)-1-cyclopropyl-2-(dimethylaminomethylene)-3-(4-mesyl-1,3-benzodioxol-5-yl)propane-1,3-dione Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C(=O)C1CC1)C(=O)C2=C(C3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CN(C)/C=C(\C(=O)C1CC1)/C(=O)C2=C(C3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C17H19NO6S/c1-18(2)8-12(14(19)10-4-5-10)15(20)11-6-7-13-16(24-9-23-13)17(11)25(3,21)22/h6-8,10H,4-5,9H2,1-3H3/b12-8+