[[[3-(phenylmethyl)phenyl]amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[[3-(phenylmethyl)phenyl]amino]-phosphono-methyl]phosphonic acid Openeye Name: [(3-benzylanilino)-phosphono-methyl]phosphonic acid CAS Name: [[3-(phenylmethyl)anilino]-phosphonomethyl]phosphonic acid IUPAC Name: [(3-benzylanilino)-phosphonomethyl]phosphonic acid Traditional Name: [(3-benzylanilino)-phosphono-methyl]phosphonic acid Formula: C14H17NO6P2 MolecularWeight: 357.235402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CC=C2)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CC=C2)NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H17NO6P2/c16-22(17,18)14(23(19,20)21)15-13-8-4-7-12(10-13)9-11-5-2-1-3-6-11/h1-8,10,14-15H,9H2,(H2,16,17,18)(H2,19,20,21)