prop-2-ynyl 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name: prop-2-ynyl 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate Openeye Name: prop-2-ynyl 4-(benzylamino)-4-oxo-butanoate CAS Name: 4-oxo-4-[(phenylmethyl)amino]butanoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-(benzylamino)-4-oxobutanoate Traditional Name: 4-(benzylamino)-4-keto-butyric acid propargyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)CCC(=O)NCC1=CC=CC=C1

Isomeric SMILES

C#CCOC(=O)CCC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C14H15NO3/c1-2-10-18-14(17)9-8-13(16)15-11-12-6-4-3-5-7-12/h1,3-7H,8-11H2,(H,15,16)