ethyl (E)-4-oxidanylidene-4-[(phenylmethyl)amino]but-2-enoate

Systemtic Name: ethyl (E)-4-oxidanylidene-4-[(phenylmethyl)amino]but-2-enoate Openeye Name: ethyl (E)-4-(benzylamino)-4-oxo-but-2-enoate CAS Name: (E)-4-oxo-4-[(phenylmethyl)amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(benzylamino)-4-oxobut-2-enoate Traditional Name: (E)-4-(benzylamino)-4-keto-but-2-enoic acid ethyl ester Formula: C13H15NO3 MolecularWeight: 233.2631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C13H15NO3/c1-2-17-13(16)9-8-12(15)14-10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,14,15)/b9-8+