phenacyl 4-[[3-chloranyl-4-(4-methylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenacyl 4-[[3-chloranyl-4-(4-methylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenacyl 4-[3-chloro-4-(4-methylphenoxy)anilino]-4-oxo-butanoate CAS Name: 4-[3-chloro-4-(4-methylphenoxy)anilino]-4-oxobutanoic acid phenacyl ester IUPAC Name: phenacyl 4-[3-chloro-4-(4-methylphenoxy)anilino]-4-oxobutanoate Traditional Name: 4-[3-chloro-4-(4-methylphenoxy)anilino]-4-keto-butyric acid phenacyl ester Formula: C25H22ClNO5 MolecularWeight: 451.89888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C25H22ClNO5/c1-17-7-10-20(11-8-17)32-23-12-9-19(15-21(23)26)27-24(29)13-14-25(30)31-16-22(28)18-5-3-2-4-6-18/h2-12,15H,13-14,16H2,1H3,(H,27,29)