[[3-(dimethylaminomethyl)phenyl]methyl-(phosphonomethyl)amino]methylphosphonic acid

Systemtic Name: [[3-(dimethylaminomethyl)phenyl]methyl-(phosphonomethyl)amino]methylphosphonic acid Openeye Name: [[3-(dimethylaminomethyl)phenyl]methyl-(phosphonomethyl)amino]methylphosphonic acid CAS Name: [[3-(dimethylaminomethyl)phenyl]methyl-(phosphonomethyl)amino]methylphosphonic acid IUPAC Name: [[3-(dimethylaminomethyl)phenyl]methyl-(phosphonomethyl)amino]methylphosphonic acid Traditional Name: [[3-(dimethylaminomethyl)benzyl]-(phosphonomethyl)amino]methylphosphonic acid Formula: C12H22N2O6P2 MolecularWeight: 352.260402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)CN(CP(=O)(O)O)CP(=O)(O)O

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)CN(CP(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C12H22N2O6P2/c1-13(2)7-11-4-3-5-12(6-11)8-14(9-21(15,16)17)10-22(18,19)20/h3-6H,7-10H2,1-2H3,(H2,15,16,17)(H2,18,19,20)