N-[[(2S)-butan-2-yl]carbamoyl]-2-(3-ethenylbenzimidazol-1-ium-1-yl)ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(3-ethenylbenzimidazol-1-ium-1-yl)ethanamide Openeye Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-(3-vinylbenzimidazol-1-ium-1-yl)acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-(3-ethenyl-1-benzimidazol-1-iumyl)acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(3-ethenylbenzimidazol-1-ium-1-yl)acetamide Traditional Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-(3-vinylbenzimidazol-1-ium-1-yl)acetamide Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[N+]1=CN(C2=CC=CC=C21)C=C

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[N+]1=CN(C2=CC=CC=C21)C=C

InChI

InChI=1S/C16H20N4O2/c1-4-12(3)17-16(22)18-15(21)10-20-11-19(5-2)13-8-6-7-9-14(13)20/h5-9,11-12H,2,4,10H2,1,3H3,(H-,17,18,21,22)/p+1/t12-/m0/s1