cyclopropyl-[2-(2-methoxy-5-nitro-phenoxy)ethyl]azanium

Systemtic Name: cyclopropyl-[2-(2-methoxy-5-nitro-phenoxy)ethyl]azanium Openeye Name: cyclopropyl-[2-(2-methoxy-5-nitro-phenoxy)ethyl]ammonium CAS Name: cyclopropyl-[2-(2-methoxy-5-nitrophenoxy)ethyl]ammonium IUPAC Name: cyclopropyl-[2-(2-methoxy-5-nitrophenoxy)ethyl]azanium Traditional Name: cyclopropyl-[2-(2-methoxy-5-nitro-phenoxy)ethyl]ammonium Formula: C12H17N2O4+ MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC[NH2+]C2CC2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC[NH2+]C2CC2

InChI

InChI=1S/C12H16N2O4/c1-17-11-5-4-10(14(15)16)8-12(11)18-7-6-13-9-2-3-9/h4-5,8-9,13H,2-3,6-7H2,1H3/p+1