methyl 1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxylate CAS Name: 1-[[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H26N2O7S/c1-27-20(24)16-3-2-8-22(16)19(23)14-6-9-21(10-7-14)30(25,26)15-4-5-17-18(13-15)29-12-11-28-17/h4-5,13-14,16H,2-3,6-12H2,1H3