2-azanyl-2-[(3,4-dichlorophenyl)methyl]-4-phosphono-butanoic acid

Systemtic Name: 2-azanyl-2-[(3,4-dichlorophenyl)methyl]-4-phosphono-butanoic acid Openeye Name: 2-amino-2-[(3,4-dichlorophenyl)methyl]-4-phosphono-butanoic acid CAS Name: 2-amino-2-[(3,4-dichlorophenyl)methyl]-4-phosphonobutanoic acid IUPAC Name: 2-amino-2-[(3,4-dichlorophenyl)methyl]-4-phosphonobutanoic acid Traditional Name: 2-amino-2-(3,4-dichlorobenzyl)-4-phosphono-butyric acid Formula: C11H14Cl2NO5P MolecularWeight: 342.112321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(CCP(=O)(O)O)(C(=O)O)N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC(CCP(=O)(O)O)(C(=O)O)N)Cl)Cl

InChI

InChI=1S/C11H14Cl2NO5P/c12-8-2-1-7(5-9(8)13)6-11(14,10(15)16)3-4-20(17,18)19/h1-2,5H,3-4,6,14H2,(H,15,16)(H2,17,18,19)