[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate

Systemtic Name: [(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate Openeye Name: [(E)-1-(4-morpholinophenyl)ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate CAS Name: (2S)-2-acetamido-3-phenylpropanoic acid [(E)-1-[4-(4-morpholinyl)phenyl]ethylideneamino] ester IUPAC Name: [(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenylpropanoate Traditional Name: (2S)-2-acetamido-3-phenyl-propionic acid [(E)-1-(4-morpholinophenyl)ethylideneamino] ester Formula: C23H27N3O4 MolecularWeight: 409.47818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C(CC1=CC=CC=C1)NC(=O)C)C2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

C/C(=N\OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C)/C2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C23H27N3O4/c1-17(20-8-10-21(11-9-20)26-12-14-29-15-13-26)25-30-23(28)22(24-18(2)27)16-19-6-4-3-5-7-19/h3-11,22H,12-16H2,1-2H3,(H,24,27)/b25-17+/t22-/m0/s1