4-[di(propan-2-yloxy)phosphoryl-[(4-methyl-3-nitro-phenyl)amino]methyl]benzene-1,3-diol

Systemtic Name: 4-[di(propan-2-yloxy)phosphoryl-[(4-methyl-3-nitro-phenyl)amino]methyl]benzene-1,3-diol Openeye Name: 4-[diisopropoxyphosphoryl-(4-methyl-3-nitro-anilino)methyl]benzene-1,3-diol CAS Name: 4-[di(propan-2-yloxy)phosphoryl-(4-methyl-3-nitroanilino)methyl]benzene-1,3-diol IUPAC Name: 4-[di(propan-2-yloxy)phosphoryl-(4-methyl-3-nitroanilino)methyl]benzene-1,3-diol Traditional Name: 4-[diisopropoxyphosphoryl-(4-methyl-3-nitro-anilino)methyl]resorcinol Formula: C20H27N2O7P MolecularWeight: 438.411341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N2O7P/c1-12(2)28-30(27,29-13(3)4)20(17-9-8-16(23)11-19(17)24)21-15-7-6-14(5)18(10-15)22(25)26/h6-13,20-21,23-24H,1-5H3