1-[2-[(3,5-dimethoxyphenyl)carbonylamino]ethylsulfonyl]piperidine-4-carboxylate

Systemtic Name: 1-[2-[(3,5-dimethoxyphenyl)carbonylamino]ethylsulfonyl]piperidine-4-carboxylate Openeye Name: 1-[2-[(3,5-dimethoxybenzoyl)amino]ethylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]ethylsulfonyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-[(3,5-dimethoxybenzoyl)amino]ethylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(3,5-dimethoxybenzoyl)amino]ethylsulfonyl]isonipecotate Formula: C17H23N2O7S- MolecularWeight: 399.43872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCS(=O)(=O)N2CCC(CC2)C(=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCS(=O)(=O)N2CCC(CC2)C(=O)[O-])OC

InChI

InChI=1S/C17H24N2O7S/c1-25-14-9-13(10-15(11-14)26-2)16(20)18-5-8-27(23,24)19-6-3-12(4-7-19)17(21)22/h9-12H,3-8H2,1-2H3,(H,18,20)(H,21,22)/p-1