methyl (E)-5-[(phenylmethyl)amino]pent-2-enoate

Systemtic Name: methyl (E)-5-[(phenylmethyl)amino]pent-2-enoate Openeye Name: methyl (E)-5-(benzylamino)pent-2-enoate CAS Name: (E)-5-[(phenylmethyl)amino]-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-5-(benzylamino)pent-2-enoate Traditional Name: (E)-5-(benzylamino)pent-2-enoic acid methyl ester Formula: C13H17NO2 MolecularWeight: 219.27958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCCNCC1=CC=CC=C1

Isomeric SMILES

COC(=O)/C=C/CCNCC1=CC=CC=C1

InChI

InChI=1S/C13H17NO2/c1-16-13(15)9-5-6-10-14-11-12-7-3-2-4-8-12/h2-5,7-9,14H,6,10-11H2,1H3/b9-5+