4-[diethoxyphosphoryl-[(4-methoxy-2-nitro-phenyl)amino]methyl]benzene-1,3-diol

Systemtic Name: 4-[diethoxyphosphoryl-[(4-methoxy-2-nitro-phenyl)amino]methyl]benzene-1,3-diol Openeye Name: 4-[diethoxyphosphoryl-(4-methoxy-2-nitro-anilino)methyl]benzene-1,3-diol CAS Name: 4-[diethoxyphosphoryl-(4-methoxy-2-nitroanilino)methyl]benzene-1,3-diol IUPAC Name: 4-[diethoxyphosphoryl-(4-methoxy-2-nitroanilino)methyl]benzene-1,3-diol Traditional Name: 4-[diethoxyphosphoryl-(4-methoxy-2-nitro-anilino)methyl]resorcinol Formula: C18H23N2O8P MolecularWeight: 426.357581

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=C(C=C(C=C1)O)O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C(C1=C(C=C(C=C1)O)O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])OCC

InChI

InChI=1S/C18H23N2O8P/c1-4-27-29(25,28-5-2)18(14-8-6-12(21)10-17(14)22)19-15-9-7-13(26-3)11-16(15)20(23)24/h6-11,18-19,21-22H,4-5H2,1-3H3