2-[azanyl-[4-(4-methylphenyl)phenyl]methyl]-3-oxidanylidene-2-(phosphonomethylamino)pentanoic acid

Systemtic Name: 2-[azanyl-[4-(4-methylphenyl)phenyl]methyl]-3-oxidanylidene-2-(phosphonomethylamino)pentanoic acid Openeye Name: 2-[amino-[4-(p-tolyl)phenyl]methyl]-3-oxo-2-(phosphonomethylamino)pentanoic acid CAS Name: 2-[amino-[4-(4-methylphenyl)phenyl]methyl]-3-oxo-2-(phosphonomethylamino)pentanoic acid IUPAC Name: 2-[amino-[4-(4-methylphenyl)phenyl]methyl]-3-oxo-2-(phosphonomethylamino)pentanoic acid Traditional Name: 2-[amino-[4-(p-tolyl)phenyl]methyl]-3-keto-2-(phosphonomethylamino)valeric acid Formula: C20H25N2O6P MolecularWeight: 420.396061

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(C1=CC=C(C=C1)C2=CC=C(C=C2)C)N)(C(=O)O)NCP(=O)(O)O

Isomeric SMILES

CCC(=O)C(C(C1=CC=C(C=C1)C2=CC=C(C=C2)C)N)(C(=O)O)NCP(=O)(O)O

InChI

InChI=1S/C20H25N2O6P/c1-3-17(23)20(19(24)25,22-12-29(26,27)28)18(21)16-10-8-15(9-11-16)14-6-4-13(2)5-7-14/h4-11,18,22H,3,12,21H2,1-2H3,(H,24,25)(H2,26,27,28)