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

Systemtic Name: 4-[di(propan-2-yloxy)phosphoryl-[(4-methoxy-2-nitro-phenyl)amino]methyl]benzene-1,3-diol Openeye Name: 4-[diisopropoxyphosphoryl-(4-methoxy-2-nitro-anilino)methyl]benzene-1,3-diol CAS Name: 4-[di(propan-2-yloxy)phosphoryl-(4-methoxy-2-nitroanilino)methyl]benzene-1,3-diol IUPAC Name: 4-[di(propan-2-yloxy)phosphoryl-(4-methoxy-2-nitroanilino)methyl]benzene-1,3-diol Traditional Name: 4-[diisopropoxyphosphoryl-(4-methoxy-2-nitro-anilino)methyl]resorcinol Formula: C20H27N2O8P MolecularWeight: 454.410741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C(C1=C(C=C(C=C1)O)O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])OC(C)C

Isomeric SMILES

CC(C)OP(=O)(C(C1=C(C=C(C=C1)O)O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])OC(C)C

InChI

InChI=1S/C20H27N2O8P/c1-12(2)29-31(27,30-13(3)4)20(16-8-6-14(23)10-19(16)24)21-17-9-7-15(28-5)11-18(17)22(25)26/h6-13,20-21,23-24H,1-5H3