dimethyl 5-(azepan-1-ylsulfonyl)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-(azepan-1-ylsulfonyl)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-(azepan-1-ylsulfonyl)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-(1-azepanylsulfonyl)-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(azepan-1-ylsulfonyl)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(azepan-1-ylsulfonyl)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H21NO6S2 MolecularWeight: 375.46034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)N2CCCCCC2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)N2CCCCCC2)C(=O)OC

InChI

InChI=1S/C15H21NO6S2/c1-10-11(13(17)21-2)15(23-12(10)14(18)22-3)24(19,20)16-8-6-4-5-7-9-16/h4-9H2,1-3H3