3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-2-(4-phenylbutan-2-ylamino)propanoic acid

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-2-(4-phenylbutan-2-ylamino)propanoic acid Openeye Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-[(1-methyl-3-phenyl-propyl)amino]propanoic acid CAS Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-(4-phenylbutan-2-ylamino)propanoic acid IUPAC Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-(4-phenylbutan-2-ylamino)propanoic acid Traditional Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-[(1-methyl-3-phenyl-propyl)amino]propionic acid Formula: C19H23NO5 MolecularWeight: 345.38962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(C(C2=CC(=C(C=C2)O)O)O)C(=O)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(C(C2=CC(=C(C=C2)O)O)O)C(=O)O

InChI

InChI=1S/C19H23NO5/c1-12(7-8-13-5-3-2-4-6-13)20-17(19(24)25)18(23)14-9-10-15(21)16(22)11-14/h2-6,9-12,17-18,20-23H,7-8H2,1H3,(H,24,25)