phenacyl 4-[[4-(4-tert-butylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenacyl 4-[[4-(4-tert-butylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenacyl 4-[4-(4-tert-butylphenoxy)anilino]-4-oxo-butanoate CAS Name: 4-[4-(4-tert-butylphenoxy)anilino]-4-oxobutanoic acid phenacyl ester IUPAC Name: phenacyl 4-[4-(4-tert-butylphenoxy)anilino]-4-oxobutanoate Traditional Name: 4-[4-(4-tert-butylphenoxy)anilino]-4-keto-butyric acid phenacyl ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H29NO5/c1-28(2,3)21-9-13-23(14-10-21)34-24-15-11-22(12-16-24)29-26(31)17-18-27(32)33-19-25(30)20-7-5-4-6-8-20/h4-16H,17-19H2,1-3H3,(H,29,31)