N1-(1-diethoxyphosphorylbutyl)-4-nitro-naphthalene-1,2-diamine

Systemtic Name: N1-(1-diethoxyphosphorylbutyl)-4-nitro-naphthalene-1,2-diamine Openeye Name: N1-(1-diethoxyphosphorylbutyl)-4-nitro-naphthalene-1,2-diamine CAS Name: N1-(1-diethoxyphosphorylbutyl)-4-nitronaphthalene-1,2-diamine IUPAC Name: 1-N-(1-diethoxyphosphorylbutyl)-4-nitronaphthalene-1,2-diamine Traditional Name: (2-amino-4-nitro-1-naphthyl)-(1-diethoxyphosphorylbutyl)amine Formula: C18H26N3O5P MolecularWeight: 395.389901

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])N)P(=O)(OCC)OCC

Isomeric SMILES

CCCC(NC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])N)P(=O)(OCC)OCC

InChI

InChI=1S/C18H26N3O5P/c1-4-9-17(27(24,25-5-2)26-6-3)20-18-14-11-8-7-10-13(14)16(21(22)23)12-15(18)19/h7-8,10-12,17,20H,4-6,9,19H2,1-3H3