cyclohexylazanium; (4-nitrophenyl) phosphate; hydrate

Systemtic Name: cyclohexylazanium; (4-nitrophenyl) phosphate; hydrate Openeye Name: cyclohexylammonium; (4-nitrophenyl) phosphate; hydrate CAS Name: cyclohexylammonium; (4-nitrophenyl) phosphate; hydrate IUPAC Name: cyclohexylazanium; (4-nitrophenyl) phosphate; hydrate Traditional Name: cyclohexylammonium; (4-nitrophenyl) phosphate; hydrate Formula: C18H34N3O7P MolecularWeight: 435.452221

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH3+].C1CCC(CC1)[NH3+].C1=CC(=CC=C1[N+](=O)[O-])OP(=O)([O-])[O-].O

Isomeric SMILES

C1CCC(CC1)[NH3+].C1CCC(CC1)[NH3+].C1=CC(=CC=C1[N+](=O)[O-])OP(=O)([O-])[O-].O

InChI

InChI=1S/C6H6NO6P.2C6H13N.H2O/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12;2*7-6-4-2-1-3-5-6;/h1-4H,(H2,10,11,12);2*6H,1-5,7H2;1H2