1-[diethoxyphosphoryl-[(2-methyl-4-nitro-phenyl)amino]methyl]naphthalen-2-ol

Systemtic Name: 1-[diethoxyphosphoryl-[(2-methyl-4-nitro-phenyl)amino]methyl]naphthalen-2-ol Openeye Name: 1-[diethoxyphosphoryl-(2-methyl-4-nitro-anilino)methyl]naphthalen-2-ol CAS Name: 1-[diethoxyphosphoryl-(2-methyl-4-nitroanilino)methyl]-2-naphthalenol IUPAC Name: 1-[diethoxyphosphoryl-(2-methyl-4-nitroanilino)methyl]naphthalen-2-ol Traditional Name: 1-[diethoxyphosphoryl-(2-methyl-4-nitro-anilino)methyl]-2-naphthol Formula: C22H25N2O6P MolecularWeight: 444.417461

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=C(C=CC2=CC=CC=C21)O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)OCC

Isomeric SMILES

CCOP(=O)(C(C1=C(C=CC2=CC=CC=C21)O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)OCC

InChI

InChI=1S/C22H25N2O6P/c1-4-29-31(28,30-5-2)22(23-19-12-11-17(24(26)27)14-15(19)3)21-18-9-7-6-8-16(18)10-13-20(21)25/h6-14,22-23,25H,4-5H2,1-3H3