hydrogen phosphate; (2-phenylcyclopropyl)azanium; hydrate

Systemtic Name: hydrogen phosphate; (2-phenylcyclopropyl)azanium; hydrate Openeye Name: hydrogen phosphate; (2-phenylcyclopropyl)ammonium; hydrate CAS Name: hydrogen phosphate; (2-phenylcyclopropyl)ammonium; hydrate IUPAC Name: hydrogen phosphate; (2-phenylcyclopropyl)azanium; hydrate Traditional Name: hydrogen phosphate; (2-phenylcyclopropyl)ammonium; hydrate Formula: C18H27N2O5P MolecularWeight: 382.391141

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1[NH3+])C2=CC=CC=C2.C1C(C1[NH3+])C2=CC=CC=C2.O.OP(=O)([O-])[O-]

Isomeric SMILES

C1C(C1[NH3+])C2=CC=CC=C2.C1C(C1[NH3+])C2=CC=CC=C2.O.OP(=O)([O-])[O-]

InChI

InChI=1S/2C9H11N.H3O4P.H2O/c2*10-9-6-8(9)7-4-2-1-3-5-7;1-5(2,3)4;/h2*1-5,8-9H,6,10H2;(H3,1,2,3,4);1H2