[(2R)-2-(4-chloranyl-3-nitro-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(4-chloranyl-3-nitro-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(4-chloro-3-nitro-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(4-chloro-3-nitrophenyl)-2-(4-ethyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-chloro-3-nitrophenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(4-chloro-3-nitro-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C14H23ClN4O2+2 MolecularWeight: 314.81102

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C[NH3+])C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](C[NH3+])C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H21ClN4O2/c1-2-17-5-7-18(8-6-17)14(10-16)11-3-4-12(15)13(9-11)19(20)21/h3-4,9,14H,2,5-8,10,16H2,1H3/p+2/t14-/m0/s1