phenethyl 4-oxidanylidene-4-[[4-(3-phenylpropanoylamino)phenyl]amino]butanoate

Systemtic Name: phenethyl 4-oxidanylidene-4-[[4-(3-phenylpropanoylamino)phenyl]amino]butanoate Openeye Name: phenethyl 4-oxo-4-[4-(3-phenylpropanoylamino)anilino]butanoate CAS Name: 4-oxo-4-[4-[(1-oxo-3-phenylpropyl)amino]anilino]butanoic acid phenethyl ester IUPAC Name: phenethyl 4-oxo-4-[4-(3-phenylpropanoylamino)anilino]butanoate Traditional Name: 4-[4-(hydrocinnamoylamino)anilino]-4-keto-butyric acid phenethyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O4/c30-25(16-11-21-7-3-1-4-8-21)28-23-12-14-24(15-13-23)29-26(31)17-18-27(32)33-20-19-22-9-5-2-6-10-22/h1-10,12-15H,11,16-20H2,(H,28,30)(H,29,31)