methyl 4-oxidanylidene-4-[(4-phenoxyphenyl)amino]but-2-ynoate

Systemtic Name: methyl 4-oxidanylidene-4-[(4-phenoxyphenyl)amino]but-2-ynoate Openeye Name: methyl 4-oxo-4-(4-phenoxyanilino)but-2-ynoate CAS Name: 4-oxo-4-(4-phenoxyanilino)-2-butynoic acid methyl ester IUPAC Name: methyl 4-oxo-4-(4-phenoxyanilino)but-2-ynoate Traditional Name: 4-keto-4-(4-phenoxyanilino)but-2-ynoic acid methyl ester Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

COC(=O)C#CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C17H13NO4/c1-21-17(20)12-11-16(19)18-13-7-9-15(10-8-13)22-14-5-3-2-4-6-14/h2-10H,1H3,(H,18,19)