1,3-benzodioxol-5-yl 4-(4-methylpiperidin-1-yl)sulfonylthiophene-2-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 4-(4-methylpiperidin-1-yl)sulfonylthiophene-2-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 4-[(4-methyl-1-piperidyl)sulfonyl]thiophene-2-carboxylate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]-2-thiophenecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 4-(4-methylpiperidin-1-yl)sulfonylthiophene-2-carboxylate Traditional Name: 4-(4-methylpiperidino)sulfonylthiophene-2-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CSC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CSC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19NO6S2/c1-12-4-6-19(7-5-12)27(21,22)14-9-17(26-10-14)18(20)25-13-2-3-15-16(8-13)24-11-23-15/h2-3,8-10,12H,4-7,11H2,1H3