ethyl (2S)-2-acetamido-3-[4-(anthracen-9-ylmethoxy)phenyl]propanoate

Systemtic Name: ethyl (2S)-2-acetamido-3-[4-(anthracen-9-ylmethoxy)phenyl]propanoate Openeye Name: ethyl (2S)-2-acetamido-3-[4-(9-anthrylmethoxy)phenyl]propanoate CAS Name: (2S)-2-acetamido-3-[4-(9-anthracenylmethoxy)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-acetamido-3-[4-(anthracen-9-ylmethoxy)phenyl]propanoate Traditional Name: (2S)-2-acetamido-3-[4-(9-anthrylmethoxy)phenyl]propionic acid ethyl ester Formula: C28H27NO4 MolecularWeight: 441.51828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)OCC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)OCC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C

InChI

InChI=1S/C28H27NO4/c1-3-32-28(31)27(29-19(2)30)16-20-12-14-23(15-13-20)33-18-26-24-10-6-4-8-21(24)17-22-9-5-7-11-25(22)26/h4-15,17,27H,3,16,18H2,1-2H3,(H,29,30)/t27-/m0/s1