2-chloranyl-N-(2-dimethylaminoethyl)-5-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-dimethylaminoethyl)-5-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: 2-chloro-N-(2-dimethylaminoethyl)-5-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzamide CAS Name: 2-chloro-N-(2-dimethylaminoethyl)-5-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: 2-chloro-N-(2-dimethylaminoethyl)-5-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzamide Traditional Name: 2-chloro-N-(2-dimethylaminoethyl)-5-[(3R,5R)-3,5-dimethylpiperidino]sulfonyl-benzamide Formula: C18H28ClN3O3S MolecularWeight: 401.95122

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCN(C)C)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCN(C)C)C

InChI

InChI=1S/C18H28ClN3O3S/c1-13-9-14(2)12-22(11-13)26(24,25)15-5-6-17(19)16(10-15)18(23)20-7-8-21(3)4/h5-6,10,13-14H,7-9,11-12H2,1-4H3,(H,20,23)/t13-,14-/m1/s1