(3S)-N-(2,5-dimethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2,5-dimethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2,5-dimethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2,5-dimethoxyphenyl)-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2,5-dimethoxyphenyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2,5-dimethoxyphenyl)-1-mesyl-nipecotamide Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O5S/c1-21-12-6-7-14(22-2)13(9-12)16-15(18)11-5-4-8-17(10-11)23(3,19)20/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,16,18)/t11-/m0/s1