N'-[1-(hexylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide

Systemtic Name: N'-[1-(hexylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-(hexylamino)-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: N'-[1-(hexylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-(hexylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-(hexylamino)-2-keto-ethyl]-2-methyl-glutaramide Formula: C28H39N3O4 MolecularWeight: 481.62696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)CCC(C)C(=O)N

Isomeric SMILES

CCCCCCNC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)CCC(C)C(=O)N

InChI

InChI=1S/C28H39N3O4/c1-3-4-5-9-18-30-28(34)25(31-26(32)17-12-21(2)27(29)33)19-22-13-15-24(16-14-22)35-20-23-10-7-6-8-11-23/h6-8,10-11,13-16,21,25H,3-5,9,12,17-20H2,1-2H3,(H2,29,33)(H,30,34)(H,31,32)