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

Systemtic Name: (2S)-2-azanyl-3-[3-(3-nitrophenyl)-5-(phosphonomethyl)phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-[3-(3-nitrophenyl)-5-(phosphonomethyl)phenyl]propanoic acid CAS Name: (2S)-2-amino-3-[3-(3-nitrophenyl)-5-(phosphonomethyl)phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[3-(3-nitrophenyl)-5-(phosphonomethyl)phenyl]propanoic acid Traditional Name: (2S)-2-amino-3-[3-(3-nitrophenyl)-5-(phosphonomethyl)phenyl]propionic acid Formula: C16H17N2O7P MolecularWeight: 380.289141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC(=C2)CP(=O)(O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC(=C2)CP(=O)(O)O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C16H17N2O7P/c17-15(16(19)20)7-10-4-11(9-26(23,24)25)6-13(5-10)12-2-1-3-14(8-12)18(21)22/h1-6,8,15H,7,9,17H2,(H,19,20)(H2,23,24,25)/t15-/m0/s1