ethyl 3-oxidanylidene-2-[2-(prop-2-enylamino)phenyl]carbonyl-butanoate

Systemtic Name: ethyl 3-oxidanylidene-2-[2-(prop-2-enylamino)phenyl]carbonyl-butanoate Openeye Name: ethyl 2-[2-(allylamino)benzoyl]-3-oxo-butanoate CAS Name: 3-oxo-2-[oxo-[2-(prop-2-enylamino)phenyl]methyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-2-[2-(prop-2-enylamino)benzoyl]butanoate Traditional Name: 2-[2-(allylamino)benzoyl]-3-keto-butyric acid ethyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)C(=O)C1=CC=CC=C1NCC=C

Isomeric SMILES

CCOC(=O)C(C(=O)C)C(=O)C1=CC=CC=C1NCC=C

InChI

InChI=1S/C16H19NO4/c1-4-10-17-13-9-7-6-8-12(13)15(19)14(11(3)18)16(20)21-5-2/h4,6-9,14,17H,1,5,10H2,2-3H3