N-[diethoxyphosphoryl(phenyl)methyl]-2,4-dinitro-naphthalen-1-amine

Systemtic Name: N-[diethoxyphosphoryl(phenyl)methyl]-2,4-dinitro-naphthalen-1-amine Openeye Name: N-[diethoxyphosphoryl(phenyl)methyl]-2,4-dinitro-naphthalen-1-amine CAS Name: N-[diethoxyphosphoryl(phenyl)methyl]-2,4-dinitro-1-naphthalenamine IUPAC Name: N-[diethoxyphosphoryl(phenyl)methyl]-2,4-dinitronaphthalen-1-amine Traditional Name: [diethoxyphosphoryl(phenyl)methyl]-(2,4-dinitro-1-naphthyl)amine Formula: C21H22N3O7P MolecularWeight: 459.389041

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC=C1)NC2=C(C=C(C3=CC=CC=C32)[N+](=O)[O-])[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=CC=C1)NC2=C(C=C(C3=CC=CC=C32)[N+](=O)[O-])[N+](=O)[O-])OCC

InChI

InChI=1S/C21H22N3O7P/c1-3-30-32(29,31-4-2)21(15-10-6-5-7-11-15)22-20-17-13-9-8-12-16(17)18(23(25)26)14-19(20)24(27)28/h5-14,21-22H,3-4H2,1-2H3