methyl (2S)-2-[(2,4-dimethoxyphenyl)methylamino]pent-4-enoate

Systemtic Name: methyl (2S)-2-[(2,4-dimethoxyphenyl)methylamino]pent-4-enoate Openeye Name: methyl (2S)-2-[(2,4-dimethoxyphenyl)methylamino]pent-4-enoate CAS Name: (2S)-2-[(2,4-dimethoxyphenyl)methylamino]-4-pentenoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2,4-dimethoxyphenyl)methylamino]pent-4-enoate Traditional Name: (2S)-2-[(2,4-dimethoxybenzyl)amino]pent-4-enoic acid methyl ester Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(CC=C)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN[C@@H](CC=C)C(=O)OC)OC

InChI

InChI=1S/C15H21NO4/c1-5-6-13(15(17)20-4)16-10-11-7-8-12(18-2)9-14(11)19-3/h5,7-9,13,16H,1,6,10H2,2-4H3/t13-/m0/s1