N-[4-bromanyl-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-phenyl]-N',N'-dimethyl-butanediamide

Systemtic Name: N-[4-bromanyl-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-phenyl]-N',N'-dimethyl-butanediamide Openeye Name: N-[4-bromo-2-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-N',N'-dimethyl-butanediamide CAS Name: N-[4-bromo-2-[[(3R,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]phenyl]-N',N'-dimethylbutanediamide IUPAC Name: N-[4-bromo-2-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-N',N'-dimethylbutanediamide Traditional Name: N-[4-bromo-2-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-N',N'-dimethyl-succinamide Formula: C20H28BrN3O3 MolecularWeight: 438.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCC(=O)N(C)C)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCC(=O)N(C)C)C

InChI

InChI=1S/C20H28BrN3O3/c1-13-9-14(2)12-24(11-13)20(27)16-10-15(21)5-6-17(16)22-18(25)7-8-19(26)23(3)4/h5-6,10,13-14H,7-9,11-12H2,1-4H3,(H,22,25)/t13-,14+