(2S)-2-azanyl-3-[5-(2-methylphenyl)-2-oxidanyl-3-(phosphonomethyl)phenyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[5-(2-methylphenyl)-2-oxidanyl-3-(phosphonomethyl)phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-[2-hydroxy-5-(o-tolyl)-3-(phosphonomethyl)phenyl]propanoic acid CAS Name: (2S)-2-amino-3-[2-hydroxy-5-(2-methylphenyl)-3-(phosphonomethyl)phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[2-hydroxy-5-(2-methylphenyl)-3-(phosphonomethyl)phenyl]propanoic acid Traditional Name: (2S)-2-amino-3-[2-hydroxy-5-(o-tolyl)-3-(phosphonomethyl)phenyl]propionic acid Formula: C17H20NO6P MolecularWeight: 365.317561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C(=C2)CP(=O)(O)O)O)CC(C(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C(=C2)CP(=O)(O)O)O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C17H20NO6P/c1-10-4-2-3-5-14(10)11-6-12(8-15(18)17(20)21)16(19)13(7-11)9-25(22,23)24/h2-7,15,19H,8-9,18H2,1H3,(H,20,21)(H2,22,23,24)/t15-/m0/s1