(2-methoxycarbonylfuran-3-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate

Systemtic Name: (2-methoxycarbonylfuran-3-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate Openeye Name: (2-methoxycarbonyl-3-furyl)methyl 1-indan-5-ylsulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinecarboxylic acid (2-methoxycarbonyl-3-furanyl)methyl ester IUPAC Name: (2-methoxycarbonylfuran-3-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate Traditional Name: 1-indan-5-ylsulfonylisonipecotic acid (2-carbomethoxy-3-furyl)methyl ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC(=O)C1=C(C=CO1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H25NO7S/c1-28-22(25)20-18(9-12-29-20)14-30-21(24)16-7-10-23(11-8-16)31(26,27)19-6-5-15-3-2-4-17(15)13-19/h5-6,9,12-13,16H,2-4,7-8,10-11,14H2,1H3