azane; 2-(4-chloranyl-3-nitro-phenyl)-N,N-diethyl-ethanamine

Systemtic Name: azane; 2-(4-chloranyl-3-nitro-phenyl)-N,N-diethyl-ethanamine Openeye Name: ammonia; 2-(4-chloro-3-nitro-phenyl)-N,N-diethyl-ethanamine CAS Name: ammonia; 2-(4-chloro-3-nitrophenyl)-N,N-diethylethanamine IUPAC Name: azane; 2-(4-chloro-3-nitrophenyl)-N,N-diethylethanamine Traditional Name: ammonia; 2-(4-chloro-3-nitro-phenyl)ethyl-diethyl-amine Formula: C12H20ClN3O2 MolecularWeight: 273.7591

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=CC(=C(C=C1)Cl)[N+](=O)[O-].N

Isomeric SMILES

CCN(CC)CCC1=CC(=C(C=C1)Cl)[N+](=O)[O-].N

InChI

InChI=1S/C12H17ClN2O2.H3N/c1-3-14(4-2)8-7-10-5-6-11(13)12(9-10)15(16)17;/h5-6,9H,3-4,7-8H2,1-2H3;1H3