(3S)-N-(4-ethylphenyl)-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-ethylphenyl)-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-ethylphenyl)-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(4-ethylphenyl)-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-ethylphenyl)-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(4-ethylphenyl)-1-mesyl-nipecotamide Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O3S/c1-3-12-6-8-14(9-7-12)16-15(18)13-5-4-10-17(11-13)21(2,19)20/h6-9,13H,3-5,10-11H2,1-2H3,(H,16,18)/t13-/m0/s1