2-[4-[(4-nitro-1H-pyrrol-2-yl)carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(4-nitro-1H-pyrrol-2-yl)carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(4-nitro-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(4-nitro-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(4-nitro-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C15H22N5O4+ MolecularWeight: 336.36628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CN3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CN3)[N+](=O)[O-]

InChI

InChI=1S/C15H21N5O4/c21-14(18-3-1-2-4-18)11-17-5-7-19(8-6-17)15(22)13-9-12(10-16-13)20(23)24/h9-10,16H,1-8,11H2/p+1