(3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(3-ethoxypropyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-nipecotamide Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O5S/c1-4-26-12-6-10-20-19(22)16-7-5-11-21(14-16)27(23,24)17-8-9-18(25-3)15(2)13-17/h8-9,13,16H,4-7,10-12,14H2,1-3H3,(H,20,22)/t16-/m0/s1