N-(prop-2-enylcarbamoyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(prop-2-enylcarbamoyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(prop-2-enylcarbamoyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(allylcarbamoyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C15H23N5O2+2 MolecularWeight: 305.37542

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C15H21N5O2/c1-2-6-17-15(22)18-14(21)12-19-8-10-20(11-9-19)13-5-3-4-7-16-13/h2-5,7H,1,6,8-12H2,(H2,17,18,21,22)/p+2