(2S,3R)-5-methyl-3-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-5-methyl-3-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-2-propyl-hexanamide Openeye Name: (2S,3R)-5-methyl-3-[4-(o-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide CAS Name: (2S,3R)-5-methyl-3-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-2-propylhexanamide IUPAC Name: (2S,3R)-5-methyl-3-[4-(2-methylphenyl)piperazine-1-carbonyl]-2-propylhexanamide Traditional Name: (2S,3R)-5-methyl-3-[4-(o-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCN(CC1)C2=CC=CC=C2C)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCN(CC1)C2=CC=CC=C2C)C(=O)N

InChI

InChI=1S/C22H35N3O2/c1-5-8-18(21(23)26)19(15-16(2)3)22(27)25-13-11-24(12-14-25)20-10-7-6-9-17(20)4/h6-7,9-10,16,18-19H,5,8,11-15H2,1-4H3,(H2,23,26)/t18-,19+/m0/s1