dimethyl 3-methanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-1H-indole-6,7-dicarboxylate

Systemtic Name: dimethyl 3-methanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-1H-indole-6,7-dicarboxylate Openeye Name: dimethyl 3-formyl-4-(2-methoxy-2-oxo-ethyl)sulfanyl-1H-indole-6,7-dicarboxylate CAS Name: 3-formyl-4-[(2-methoxy-2-oxoethyl)thio]-1H-indole-6,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-formyl-4-(2-methoxy-2-oxoethyl)sulfanyl-1H-indole-6,7-dicarboxylate Traditional Name: 3-formyl-4-[(2-keto-2-methoxy-ethyl)thio]-1H-indole-6,7-dicarboxylic acid dimethyl ester Formula: C16H15NO7S MolecularWeight: 365.3578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C2C(=CNC2=C(C(=C1)C(=O)OC)C(=O)OC)C=O

Isomeric SMILES

COC(=O)CSC1=C2C(=CNC2=C(C(=C1)C(=O)OC)C(=O)OC)C=O

InChI

InChI=1S/C16H15NO7S/c1-22-11(19)7-25-10-4-9(15(20)23-2)13(16(21)24-3)14-12(10)8(6-18)5-17-14/h4-6,17H,7H2,1-3H3