(3R)-1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-(3-oxidanylpropyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-(3-oxidanylpropyl)piperidine-3-carboxamide Openeye Name: (3R)-1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-(3-hydroxypropyl)piperidine-3-carboxamide CAS Name: (3R)-1-(4-ethoxy-3-methylphenyl)sulfonyl-N-(3-hydroxypropyl)-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-ethoxy-3-methylphenyl)sulfonyl-N-(3-hydroxypropyl)piperidine-3-carboxamide Traditional Name: (3R)-1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-(3-hydroxypropyl)nipecotamide Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCO)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NCCCO)C

InChI

InChI=1S/C18H28N2O5S/c1-3-25-17-8-7-16(12-14(17)2)26(23,24)20-10-4-6-15(13-20)18(22)19-9-5-11-21/h7-8,12,15,21H,3-6,9-11,13H2,1-2H3,(H,19,22)/t15-/m1/s1