3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-oxidanylpropanoyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide

Systemtic Name: 3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-oxidanylpropanoyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide Openeye Name: 3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-hydroxypropanoyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide CAS Name: 3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-hydroxy-1-oxopropyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide IUPAC Name: 3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-hydroxypropanoyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide Traditional Name: 3-[(1R,5R)-8-[2-[2-ethylbutyl-[(2R)-2-hydroxypropanoyl]amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide Formula: C25H39N3O3 MolecularWeight: 429.59546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN(CCN1C2CCC1CC(C2)C3=CC=CC(=C3)C(=O)N)C(=O)C(C)O

Isomeric SMILES

CCC(CC)CN(CCN1[C@@H]2CC[C@@H]1CC(C2)C3=CC=CC(=C3)C(=O)N)C(=O)[C@@H](C)O

InChI

InChI=1S/C25H39N3O3/c1-4-18(5-2)16-27(25(31)17(3)29)11-12-28-22-9-10-23(28)15-21(14-22)19-7-6-8-20(13-19)24(26)30/h6-8,13,17-18,21-23,29H,4-5,9-12,14-16H2,1-3H3,(H2,26,30)/t17-,22-,23-/m1/s1