(3S)-N-(2-ethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-ethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2-ethoxyphenyl)-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2-ethoxyphenyl)-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-ethoxyphenyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-1-mesyl-N-o-phenetyl-nipecotamide Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O4S/c1-3-21-14-9-5-4-8-13(14)16-15(18)12-7-6-10-17(11-12)22(2,19)20/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1