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

Systemtic Name: N'-[1-(cycloheptylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-(cycloheptylamino)-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: N'-[1-(cycloheptylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-(cycloheptylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-(cycloheptylamino)-2-keto-ethyl]-2-methyl-glutaramide Formula: C29H39N3O4 MolecularWeight: 493.63766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC3CCCCCC3)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC3CCCCCC3)C(=O)N

InChI

InChI=1S/C29H39N3O4/c1-21(28(30)34)13-18-27(33)32-26(29(35)31-24-11-7-2-3-8-12-24)19-22-14-16-25(17-15-22)36-20-23-9-5-4-6-10-23/h4-6,9-10,14-17,21,24,26H,2-3,7-8,11-13,18-20H2,1H3,(H2,30,34)(H,31,35)(H,32,33)