(2R)-4-(2-chloranyl-4-nitro-phenyl)piperazin-1-ium-2-carboxamide

Systemtic Name: (2R)-4-(2-chloranyl-4-nitro-phenyl)piperazin-1-ium-2-carboxamide Openeye Name: (2R)-4-(2-chloro-4-nitro-phenyl)piperazin-1-ium-2-carboxamide CAS Name: (2R)-4-(2-chloro-4-nitrophenyl)-2-piperazin-1-iumcarboxamide IUPAC Name: (2R)-4-(2-chloro-4-nitrophenyl)piperazin-1-ium-2-carboxamide Traditional Name: (2R)-4-(2-chloro-4-nitro-phenyl)piperazin-1-ium-2-carboxamide Formula: C11H14ClN4O3+ MolecularWeight: 285.70686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)C(=O)N)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(C[C@@H]([NH2+]1)C(=O)N)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H13ClN4O3/c12-8-5-7(16(18)19)1-2-10(8)15-4-3-14-9(6-15)11(13)17/h1-2,5,9,14H,3-4,6H2,(H2,13,17)/p+1/t9-/m1/s1