methyl 4-oxidanylidene-4-[3-(prop-2-enylamino)phenyl]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[3-(prop-2-enylamino)phenyl]butanoate Openeye Name: methyl 4-[3-(allylamino)phenyl]-4-oxo-butanoate CAS Name: 4-oxo-4-[3-(prop-2-enylamino)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[3-(prop-2-enylamino)phenyl]butanoate Traditional Name: 4-[3-(allylamino)phenyl]-4-keto-butyric acid methyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=CC(=CC=C1)NCC=C

Isomeric SMILES

COC(=O)CCC(=O)C1=CC(=CC=C1)NCC=C

InChI

InChI=1S/C14H17NO3/c1-3-9-15-12-6-4-5-11(10-12)13(16)7-8-14(17)18-2/h3-6,10,15H,1,7-9H2,2H3