butane; [(4-nitrophenoxy)sulfonyl-phosphooxy-methylidene]-(phenylmethylidene)azanium

Systemtic Name: butane; [(4-nitrophenoxy)sulfonyl-phosphooxy-methylidene]-(phenylmethylidene)azanium Openeye Name: benzylidene-[(4-nitrophenoxy)sulfonyl-phosphooxy-methylene]ammonium; butane CAS Name: butane; [(4-nitrophenoxy)sulfonyl-phosphooxymethylidene]-(phenylmethylene)ammonium IUPAC Name: benzylidene-[(4-nitrophenoxy)sulfonyl-phosphooxymethylidene]azanium; butane Traditional Name: benzal-[(4-nitrophenoxy)sulfonyl-phosphooxy-methylene]ammonium; n-butane Formula: C18H20N2O8PS+ MolecularWeight: 455.398761

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.C1=CC=C(C=C1)C=[N+]=C(O[P+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC.C1=CC=C(C=C1)C=[N+]=C(O[P+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O8PS.C4H10/c17-16(18)12-6-8-13(9-7-12)24-26(21,22)14(23-25(19)20)15-10-11-4-2-1-3-5-11;1-3-4-2/h1-10H;3-4H2,1-2H3/q+1;