[(1S)-2-azaniumyl-1-(4-chloranyl-3-nitro-phenyl)ethyl]-cyclohexyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-chloranyl-3-nitro-phenyl)ethyl]-cyclohexyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-chloro-3-nitro-phenyl)ethyl]-cyclohexyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-chloro-3-nitrophenyl)ethyl]-cyclohexyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-chloro-3-nitrophenyl)ethyl]-cyclohexyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(4-chloro-3-nitro-phenyl)ethyl]-cyclohexyl-methyl-ammonium Formula: C15H24ClN3O2+2 MolecularWeight: 313.82296

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C(C[NH3+])C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C1CCCCC1)[C@H](C[NH3+])C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H22ClN3O2/c1-18(12-5-3-2-4-6-12)15(10-17)11-7-8-13(16)14(9-11)19(20)21/h7-9,12,15H,2-6,10,17H2,1H3/p+2/t15-/m1/s1