(2S,3R)-3-[4-(1,3-benzodioxol-5-ylmethylamino)piperidin-1-yl]carbonyl-5-methyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-3-[4-(1,3-benzodioxol-5-ylmethylamino)piperidin-1-yl]carbonyl-5-methyl-2-propyl-hexanamide Openeye Name: (2S,3R)-3-[4-(1,3-benzodioxol-5-ylmethylamino)piperidine-1-carbonyl]-5-methyl-2-propyl-hexanamide CAS Name: (2S,3R)-3-[[4-(1,3-benzodioxol-5-ylmethylamino)-1-piperidinyl]-oxomethyl]-5-methyl-2-propylhexanamide IUPAC Name: (2S,3R)-3-[4-(1,3-benzodioxol-5-ylmethylamino)piperidine-1-carbonyl]-5-methyl-2-propylhexanamide Traditional Name: (2S,3R)-5-methyl-3-[4-(piperonylamino)piperidine-1-carbonyl]-2-propyl-hexanamide Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCC(CC1)NCC2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCC(CC1)NCC2=CC3=C(C=C2)OCO3)C(=O)N

InChI

InChI=1S/C24H37N3O4/c1-4-5-19(23(25)28)20(12-16(2)3)24(29)27-10-8-18(9-11-27)26-14-17-6-7-21-22(13-17)31-15-30-21/h6-7,13,16,18-20,26H,4-5,8-12,14-15H2,1-3H3,(H2,25,28)/t19-,20+/m0/s1