N-[diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-4-methoxy-2-nitro-aniline

Systemtic Name: N-[diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-4-methoxy-2-nitro-aniline Openeye Name: N-[diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-4-methoxy-2-nitro-aniline CAS Name: N-[diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-4-methoxy-2-nitroaniline IUPAC Name: N-[diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-4-methoxy-2-nitroaniline Traditional Name: [diethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methyl]-(4-methoxy-2-nitro-phenyl)amine Formula: C21H29N2O9P MolecularWeight: 484.436721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N2O9P/c1-7-31-33(26,32-8-2)21(14-11-18(28-4)20(30-6)19(12-14)29-5)22-16-10-9-15(27-3)13-17(16)23(24)25/h9-13,21-22H,7-8H2,1-6H3