(3S)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N,N-diethyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-N,N-diethyl-piperidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-methoxyphenyl)sulfonyl-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-methoxyphenyl)sulfonyl-N,N-diethylpiperidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-N,N-diethyl-nipecotamide Formula: C17H25ClN2O4S MolecularWeight: 388.9094

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H25ClN2O4S/c1-4-19(5-2)17(21)13-7-6-10-20(12-13)25(22,23)14-8-9-16(24-3)15(18)11-14/h8-9,11,13H,4-7,10,12H2,1-3H3/t13-/m0/s1