N'-[1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide

Systemtic Name: N'-[1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: N'-[1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-(2,5-dimethyl-3-pyrrolin-1-yl)-2-keto-ethyl]-2-methyl-glutaramide Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)CCC(C)C(=O)N)C

Isomeric SMILES

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)CCC(C)C(=O)N)C

InChI

InChI=1S/C28H35N3O4/c1-19(27(29)33)9-16-26(32)30-25(28(34)31-20(2)10-11-21(31)3)17-22-12-14-24(15-13-22)35-18-23-7-5-4-6-8-23/h4-8,10-15,19-21,25H,9,16-18H2,1-3H3,(H2,29,33)(H,30,32)