(3S)-1-(3-chloranyl-4-ethoxy-phenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(3-chloranyl-4-ethoxy-phenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-ethoxy-phenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-ethoxyphenyl)sulfonyl-N-ethyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-ethoxyphenyl)sulfonyl-N-ethylpiperidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-ethoxy-phenyl)sulfonyl-N-ethyl-nipecotamide Formula: C16H23ClN2O4S MolecularWeight: 374.88282

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC)Cl

Isomeric SMILES

CCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC)Cl

InChI

InChI=1S/C16H23ClN2O4S/c1-3-18-16(20)12-6-5-9-19(11-12)24(21,22)13-7-8-15(23-4-2)14(17)10-13/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,18,20)/t12-/m0/s1