4-azanyl-3-(4-phenylphenyl)-2-(phosphonomethylamino)-5-propanoyl-benzoic acid

Systemtic Name: 4-azanyl-3-(4-phenylphenyl)-2-(phosphonomethylamino)-5-propanoyl-benzoic acid Openeye Name: 4-amino-3-(4-phenylphenyl)-2-(phosphonomethylamino)-5-propanoyl-benzoic acid CAS Name: 4-amino-5-(1-oxopropyl)-3-(4-phenylphenyl)-2-(phosphonomethylamino)benzoic acid IUPAC Name: 4-amino-3-(4-phenylphenyl)-2-(phosphonomethylamino)-5-propanoylbenzoic acid Traditional Name: 4-amino-3-(4-phenylphenyl)-2-(phosphonomethylamino)-5-propionyl-benzoic acid Formula: C23H23N2O6P MolecularWeight: 454.412281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C(=C1N)C2=CC=C(C=C2)C3=CC=CC=C3)NCP(=O)(O)O)C(=O)O

Isomeric SMILES

CCC(=O)C1=CC(=C(C(=C1N)C2=CC=C(C=C2)C3=CC=CC=C3)NCP(=O)(O)O)C(=O)O

InChI

InChI=1S/C23H23N2O6P/c1-2-19(26)17-12-18(23(27)28)22(25-13-32(29,30)31)20(21(17)24)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-12,25H,2,13,24H2,1H3,(H,27,28)(H2,29,30,31)