3-(2-chloranyl-4-nitro-phenoxy)propyl-propyl-azanium

Systemtic Name: 3-(2-chloranyl-4-nitro-phenoxy)propyl-propyl-azanium Openeye Name: 3-(2-chloro-4-nitro-phenoxy)propyl-propyl-ammonium CAS Name: 3-(2-chloro-4-nitrophenoxy)propyl-propylammonium IUPAC Name: 3-(2-chloro-4-nitrophenoxy)propyl-propylazanium Traditional Name: 3-(2-chloro-4-nitro-phenoxy)propyl-propyl-ammonium Formula: C12H18ClN2O3+ MolecularWeight: 273.73592

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CCCOC1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCC[NH2+]CCCOC1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H17ClN2O3/c1-2-6-14-7-3-8-18-12-5-4-10(15(16)17)9-11(12)13/h4-5,9,14H,2-3,6-8H2,1H3/p+1