aziridin-2-one; 2-(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanyl-1-methyl-3-oxidanylidene-2H-indene-1-carboxylic acid

Systemtic Name: aziridin-2-one; 2-(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanyl-1-methyl-3-oxidanylidene-2H-indene-1-carboxylic acid Openeye Name: aziridin-2-one; 2-(2-methoxy-1-methyl-2-oxo-ethyl)sulfanyl-1-methyl-3-oxo-indane-1-carboxylic acid CAS Name: 2-aziridinone; 2-[(1-methoxy-1-oxopropan-2-yl)thio]-1-methyl-3-oxo-2H-indene-1-carboxylic acid IUPAC Name: aziridin-2-one; 2-(1-methoxy-1-oxopropan-2-yl)sulfanyl-1-methyl-3-oxo-2H-indene-1-carboxylic acid Traditional Name: ethylenimin-2-one; 3-keto-2-[(2-keto-2-methoxy-1-methyl-ethyl)thio]-1-methyl-indane-1-carboxylic acid Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1C(=O)C2=CC=CC=C2C1(C)C(=O)O.C1C(=O)N1

Isomeric SMILES

CC(C(=O)OC)SC1C(=O)C2=CC=CC=C2C1(C)C(=O)O.C1C(=O)N1

InChI

InChI=1S/C15H16O5S.C2H3NO/c1-8(13(17)20-3)21-12-11(16)9-6-4-5-7-10(9)15(12,2)14(18)19;4-2-1-3-2/h4-8,12H,1-3H3,(H,18,19);1H2,(H,3,4)