1,3-benzodioxol-5-yl 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]nipecotic acid 1,3-benzodioxol-5-yl ester Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19NO6S2/c1-12-4-7-17(26-12)27(21,22)19-8-2-3-13(10-19)18(20)25-14-5-6-15-16(9-14)24-11-23-15/h4-7,9,13H,2-3,8,10-11H2,1H3