N-[diethoxyphosphoryl-(4-dimethylaminophenyl)methyl]-4-methoxy-2-nitro-aniline

Systemtic Name: N-[diethoxyphosphoryl-(4-dimethylaminophenyl)methyl]-4-methoxy-2-nitro-aniline Openeye Name: N-[diethoxyphosphoryl-(4-dimethylaminophenyl)methyl]-4-methoxy-2-nitro-aniline CAS Name: N-[diethoxyphosphoryl-(4-dimethylaminophenyl)methyl]-4-methoxy-2-nitroaniline IUPAC Name: N-[diethoxyphosphoryl-(4-dimethylaminophenyl)methyl]-4-methoxy-2-nitroaniline Traditional Name: [4-[diethoxyphosphoryl-(4-methoxy-2-nitro-anilino)methyl]phenyl]-dimethyl-amine Formula: C20H28N3O6P MolecularWeight: 437.426581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N3O6P/c1-6-28-30(26,29-7-2)20(15-8-10-16(11-9-15)22(3)4)21-18-13-12-17(27-5)14-19(18)23(24)25/h8-14,20-21H,6-7H2,1-5H3