(3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-tert-butyl-1-(3,4-dimethoxyphenyl)sulfonyl-nipecotamide Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)NC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H28N2O5S/c1-18(2,3)19-17(21)13-7-6-10-20(12-13)26(22,23)14-8-9-15(24-4)16(11-14)25-5/h8-9,11,13H,6-7,10,12H2,1-5H3,(H,19,21)/t13-/m0/s1