diethyl 2-[[4-(heptadecanoylamino)phenyl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[4-(heptadecanoylamino)phenyl]methylidene]propanedioate Openeye Name: diethyl 2-[[4-(heptadecanoylamino)phenyl]methylene]propanedioate CAS Name: 2-[[4-(1-oxoheptadecylamino)phenyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(heptadecanoylamino)phenyl]methylidene]propanedioate Traditional Name: 2-[4-(heptadecanoylamino)benzylidene]malonic acid diethyl ester Formula: C31H49NO5 MolecularWeight: 515.72446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H49NO5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29(33)32-27-23-21-26(22-24-27)25-28(30(34)36-5-2)31(35)37-6-3/h21-25H,4-20H2,1-3H3,(H,32,33)