(2-chlorophenyl)-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-yl]methanone

Systemtic Name: (2-chlorophenyl)-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-yl]methanone Openeye Name: (2-chlorophenyl)-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-yl]methanone CAS Name: (2-chlorophenyl)-[4-(3-nitro-2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2-chlorophenyl)-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-yl]methanone Traditional Name: (2-chlorophenyl)-[4-(3-nitropyridin-1-ium-2-yl)piperazino]methanone Formula: C16H16ClN4O3+ MolecularWeight: 347.77624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H15ClN4O3/c17-13-5-2-1-4-12(13)16(22)20-10-8-19(9-11-20)15-14(21(23)24)6-3-7-18-15/h1-7H,8-11H2/p+1