methyl 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]propanoyl]isonipecotic acid methyl ester Formula: C19H26N2O7S MolecularWeight: 426.48394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)OC)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)OC)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

InChI

InChI=1S/C19H26N2O7S/c1-13(18(22)20-8-6-14(7-9-20)19(23)26-2)21(29(3,24)25)15-4-5-16-17(12-15)28-11-10-27-16/h4-5,12-14H,6-11H2,1-3H3