6-azanyl-5-(2-diethoxyphosphorylpropan-2-ylamino)-8-nitro-naphthalene-1-sulfonamide

Systemtic Name: 6-azanyl-5-(2-diethoxyphosphorylpropan-2-ylamino)-8-nitro-naphthalene-1-sulfonamide Openeye Name: 6-amino-5-[(1-diethoxyphosphoryl-1-methyl-ethyl)amino]-8-nitro-naphthalene-1-sulfonamide CAS Name: 6-amino-5-(2-diethoxyphosphorylpropan-2-ylamino)-8-nitro-1-naphthalenesulfonamide IUPAC Name: 6-amino-5-(2-diethoxyphosphorylpropan-2-ylamino)-8-nitronaphthalene-1-sulfonamide Traditional Name: 6-amino-5-[(1-diethoxyphosphoryl-1-methyl-ethyl)amino]-8-nitro-naphthalene-1-sulfonamide Formula: C17H25N4O7PS MolecularWeight: 460.441761

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C)(C)NC1=C2C=CC=C(C2=C(C=C1N)[N+](=O)[O-])S(=O)(=O)N)OCC

Isomeric SMILES

CCOP(=O)(C(C)(C)NC1=C2C=CC=C(C2=C(C=C1N)[N+](=O)[O-])S(=O)(=O)N)OCC

InChI

InChI=1S/C17H25N4O7PS/c1-5-27-29(24,28-6-2)17(3,4)20-16-11-8-7-9-14(30(19,25)26)15(11)13(21(22)23)10-12(16)18/h7-10,20H,5-6,18H2,1-4H3,(H2,19,25,26)