1-(3-chlorophenyl)-4-(5-nitropyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-(3-chlorophenyl)-4-(5-nitropyridin-1-ium-2-yl)piperazine Openeye Name: 1-(3-chlorophenyl)-4-(5-nitropyridin-1-ium-2-yl)piperazine CAS Name: 1-(3-chlorophenyl)-4-(5-nitro-2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(3-chlorophenyl)-4-(5-nitropyridin-1-ium-2-yl)piperazine Traditional Name: 1-(3-chlorophenyl)-4-(5-nitropyridin-1-ium-2-yl)piperazine Formula: C15H16ClN4O2+ MolecularWeight: 319.76614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H15ClN4O2/c16-12-2-1-3-13(10-12)18-6-8-19(9-7-18)15-5-4-14(11-17-15)20(21)22/h1-5,10-11H,6-9H2/p+1