(2-chloranyl-5-nitro-phenyl)methyl-(2-diethylaminoethyl)-ethyl-azanium

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl-(2-diethylaminoethyl)-ethyl-azanium Openeye Name: (2-chloro-5-nitro-phenyl)methyl-(2-diethylaminoethyl)-ethyl-ammonium CAS Name: (2-chloro-5-nitrophenyl)methyl-(2-diethylaminoethyl)-ethylammonium IUPAC Name: (2-chloro-5-nitrophenyl)methyl-(2-diethylaminoethyl)-ethylazanium Traditional Name: (2-chloro-5-nitro-benzyl)-(2-diethylaminoethyl)-ethyl-ammonium Formula: C15H25ClN3O2+ MolecularWeight: 314.8309

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCN(CC)CC)CC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC[NH+](CCN(CC)CC)CC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H24ClN3O2/c1-4-17(5-2)9-10-18(6-3)12-13-11-14(19(20)21)7-8-15(13)16/h7-8,11H,4-6,9-10,12H2,1-3H3/p+1