ethyl 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(2,5-dioxopyrrol-1-yl)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-(2,5-dioxo-1-pyrrolyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,5-dioxopyrrol-1-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-maleimido-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)N3C(=O)C=CC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)N3C(=O)C=CC3=O

InChI

InChI=1S/C16H17NO4S/c1-3-21-16(20)14-10-5-4-9(2)8-11(10)22-15(14)17-12(18)6-7-13(17)19/h6-7,9H,3-5,8H2,1-2H3