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

Systemtic Name: [(4-methyl-3-nitro-phenyl)-[(4-methylphenyl)amino]methyl]phosphonic acid Openeye Name: [(4-methylanilino)-(4-methyl-3-nitro-phenyl)methyl]phosphonic acid CAS Name: [(4-methylanilino)-(4-methyl-3-nitrophenyl)methyl]phosphonic acid IUPAC Name: [(4-methylanilino)-(4-methyl-3-nitrophenyl)methyl]phosphonic acid Traditional Name: [(4-methyl-3-nitro-phenyl)-(p-toluidino)methyl]phosphonic acid Formula: C15H17N2O5P MolecularWeight: 336.279641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(C2=CC(=C(C=C2)C)[N+](=O)[O-])P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(C2=CC(=C(C=C2)C)[N+](=O)[O-])P(=O)(O)O

InChI

InChI=1S/C15H17N2O5P/c1-10-3-7-13(8-4-10)16-15(23(20,21)22)12-6-5-11(2)14(9-12)17(18)19/h3-9,15-16H,1-2H3,(H2,20,21,22)