bis(2-methylpropyl) 2-[[4-(pentanoylamino)phenyl]methylidene]propanedioate

Systemtic Name: bis(2-methylpropyl) 2-[[4-(pentanoylamino)phenyl]methylidene]propanedioate Openeye Name: diisobutyl 2-[[4-(pentanoylamino)phenyl]methylene]propanedioate CAS Name: 2-[[4-(1-oxopentylamino)phenyl]methylidene]propanedioic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) 2-[[4-(pentanoylamino)phenyl]methylidene]propanedioate Traditional Name: 2-[4-(valerylamino)benzylidene]malonic acid diisobutyl ester Formula: C23H33NO5 MolecularWeight: 403.51182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C

InChI

InChI=1S/C23H33NO5/c1-6-7-8-21(25)24-19-11-9-18(10-12-19)13-20(22(26)28-14-16(2)3)23(27)29-15-17(4)5/h9-13,16-17H,6-8,14-15H2,1-5H3,(H,24,25)