(2S)-2-methyl-N'-[(3S,4S,7R)-7-methyl-3-oxidanyl-1-propyl-azepan-4-yl]pentanediamide

Systemtic Name: (2S)-2-methyl-N'-[(3S,4S,7R)-7-methyl-3-oxidanyl-1-propyl-azepan-4-yl]pentanediamide Openeye Name: (2S)-N'-[(3S,4S,7R)-3-hydroxy-7-methyl-1-propyl-azepan-4-yl]-2-methyl-pentanediamide CAS Name: (2S)-N'-[(3S,4S,7R)-3-hydroxy-7-methyl-1-propyl-4-azepanyl]-2-methylpentanediamide IUPAC Name: (2S)-N'-[(3S,4S,7R)-3-hydroxy-7-methyl-1-propylazepan-4-yl]-2-methylpentanediamide Traditional Name: (2S)-N'-[(3S,4S,7R)-3-hydroxy-7-methyl-1-propyl-azepan-4-yl]-2-methyl-glutaramide Formula: C16H31N3O3 MolecularWeight: 313.43564

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(C(CCC1C)NC(=O)CCC(C)C(=O)N)O

Isomeric SMILES

CCCN1C[C@@H]([C@H](CC[C@H]1C)NC(=O)CC[C@H](C)C(=O)N)O

InChI

InChI=1S/C16H31N3O3/c1-4-9-19-10-14(20)13(7-6-12(19)3)18-15(21)8-5-11(2)16(17)22/h11-14,20H,4-10H2,1-3H3,(H2,17,22)(H,18,21)/t11-,12+,13-,14-/m0/s1