N1-[diethoxyphosphoryl(phenyl)methyl]-4-nitro-naphthalene-1,2-diamine

Systemtic Name: N1-[diethoxyphosphoryl(phenyl)methyl]-4-nitro-naphthalene-1,2-diamine Openeye Name: N1-[diethoxyphosphoryl(phenyl)methyl]-4-nitro-naphthalene-1,2-diamine CAS Name: N1-[diethoxyphosphoryl(phenyl)methyl]-4-nitronaphthalene-1,2-diamine IUPAC Name: 1-N-[diethoxyphosphoryl(phenyl)methyl]-4-nitronaphthalene-1,2-diamine Traditional Name: (2-amino-4-nitro-1-naphthyl)-[diethoxyphosphoryl(phenyl)methyl]amine Formula: C21H24N3O5P MolecularWeight: 429.406121

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C21H24N3O5P/c1-3-28-30(27,29-4-2)21(15-10-6-5-7-11-15)23-20-17-13-9-8-12-16(17)19(24(25)26)14-18(20)22/h5-14,21,23H,3-4,22H2,1-2H3