N-[3-chloranyl-2-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-chloranyl-2-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-chloro-2-(dimethylamino)phenyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-chloro-2-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-2-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-chloro-2-(dimethylamino)phenyl]-1-tosyl-isonipecotamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C(=CC=C3)Cl)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C(=CC=C3)Cl)N(C)C

InChI

InChI=1S/C21H26ClN3O3S/c1-15-7-9-17(10-8-15)29(27,28)25-13-11-16(12-14-25)21(26)23-19-6-4-5-18(22)20(19)24(2)3/h4-10,16H,11-14H2,1-3H3,(H,23,26)