(1S)-1-(4-chloranyl-3-nitro-phenyl)-N,N-diethyl-ethane-1,2-diamine

Systemtic Name: (1S)-1-(4-chloranyl-3-nitro-phenyl)-N,N-diethyl-ethane-1,2-diamine Openeye Name: (1S)-1-(4-chloro-3-nitro-phenyl)-N,N-diethyl-ethane-1,2-diamine CAS Name: (1S)-1-(4-chloro-3-nitrophenyl)-N,N-diethylethane-1,2-diamine IUPAC Name: (1S)-1-(4-chloro-3-nitrophenyl)-N,N-diethylethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(4-chloro-3-nitro-phenyl)ethyl]-diethyl-amine Formula: C12H18ClN3O2 MolecularWeight: 271.74322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(CC)[C@H](CN)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H18ClN3O2/c1-3-15(4-2)12(8-14)9-5-6-10(13)11(7-9)16(17)18/h5-7,12H,3-4,8,14H2,1-2H3/t12-/m1/s1