N'-[(2S)-octan-2-yl]-N-(4-phenylmethoxyphenyl)pentanediamide

Systemtic Name: N'-[(2S)-octan-2-yl]-N-(4-phenylmethoxyphenyl)pentanediamide Openeye Name: N-(4-benzyloxyphenyl)-N'-[(1S)-1-methylheptyl]pentanediamide CAS Name: N'-[(2S)-octan-2-yl]-N-(4-phenylmethoxyphenyl)pentanediamide IUPAC Name: N'-[(2S)-octan-2-yl]-N-(4-phenylmethoxyphenyl)pentanediamide Traditional Name: N-(4-benzoxyphenyl)-N'-[(1S)-1-methylheptyl]glutaramide Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CCCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)CCCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C26H36N2O3/c1-3-4-5-7-11-21(2)27-25(29)14-10-15-26(30)28-23-16-18-24(19-17-23)31-20-22-12-8-6-9-13-22/h6,8-9,12-13,16-19,21H,3-5,7,10-11,14-15,20H2,1-2H3,(H,27,29)(H,28,30)/t21-/m0/s1