N-cyclopropyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-(3-nitro-2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide Formula: C14H21N5O3+2 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

InChI

InChI=1S/C14H19N5O3/c20-13(16-11-3-4-11)10-17-6-8-18(9-7-17)14-12(19(21)22)2-1-5-15-14/h1-2,5,11H,3-4,6-10H2,(H,16,20)/p+2