ethyl 4-(3-oxidanylidene-3-phenylazanyl-prop-1-ynyl)benzoate

Systemtic Name: ethyl 4-(3-oxidanylidene-3-phenylazanyl-prop-1-ynyl)benzoate Openeye Name: ethyl 4-(3-anilino-3-oxo-prop-1-ynyl)benzoate CAS Name: 4-(3-anilino-3-oxoprop-1-ynyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-anilino-3-oxoprop-1-ynyl)benzoate Traditional Name: 4-(3-anilino-3-keto-prop-1-ynyl)benzoic acid ethyl ester Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H15NO3/c1-2-22-18(21)15-11-8-14(9-12-15)10-13-17(20)19-16-6-4-3-5-7-16/h3-9,11-12H,2H2,1H3,(H,19,20)