N-[[(2S)-butan-2-yl]carbamoyl]-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[N+]1=CC=C(C=C1)C(CC)CC

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[N+]1=CC=C(C=C1)C(CC)CC

InChI

InChI=1S/C17H27N3O2/c1-5-13(4)18-17(22)19-16(21)12-20-10-8-15(9-11-20)14(6-2)7-3/h8-11,13-14H,5-7,12H2,1-4H3,(H-,18,19,21,22)/p+1/t13-/m0/s1