methyl 6-[(1-morpholin-4-ylsulfonylpiperidin-3-yl)carbonylamino]-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 6-[(1-morpholin-4-ylsulfonylpiperidin-3-yl)carbonylamino]-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 6-[(1-morpholinosulfonylpiperidine-3-carbonyl)amino]-1,3-benzodioxole-5-carboxylate CAS Name: 6-[[[1-(4-morpholinylsulfonyl)-3-piperidinyl]-oxomethyl]amino]-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[(1-morpholin-4-ylsulfonylpiperidine-3-carbonyl)amino]-1,3-benzodioxole-5-carboxylate Traditional Name: 6-[(1-morpholinosulfonylnipecotoyl)amino]-piperonylic acid methyl ester Formula: C19H25N3O8S MolecularWeight: 455.4821

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1NC(=O)C3CCCN(C3)S(=O)(=O)N4CCOCC4)OCO2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1NC(=O)C3CCCN(C3)S(=O)(=O)N4CCOCC4)OCO2

InChI

InChI=1S/C19H25N3O8S/c1-27-19(24)14-9-16-17(30-12-29-16)10-15(14)20-18(23)13-3-2-4-22(11-13)31(25,26)21-5-7-28-8-6-21/h9-10,13H,2-8,11-12H2,1H3,(H,20,23)