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

Systemtic Name: [[(4-methyl-3-phenyl-phenyl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [(4-methyl-3-phenyl-anilino)-phosphono-methyl]phosphonic acid CAS Name: [(4-methyl-3-phenylanilino)-phosphonomethyl]phosphonic acid IUPAC Name: [(4-methyl-3-phenylanilino)-phosphonomethyl]phosphonic acid Traditional Name: [(4-methyl-3-phenyl-anilino)-phosphono-methyl]phosphonic acid Formula: C14H17NO6P2 MolecularWeight: 357.235402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=C2

InChI

InChI=1S/C14H17NO6P2/c1-10-7-8-12(9-13(10)11-5-3-2-4-6-11)15-14(22(16,17)18)23(19,20)21/h2-9,14-15H,1H3,(H2,16,17,18)(H2,19,20,21)