methyl N-[2-(azepan-1-ium-1-yl)ethanoyl]carbamate

Systemtic Name: methyl N-[2-(azepan-1-ium-1-yl)ethanoyl]carbamate Openeye Name: methyl N-[2-(azepan-1-ium-1-yl)acetyl]carbamate CAS Name: N-[2-(1-azepan-1-iumyl)-1-oxoethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(azepan-1-ium-1-yl)acetyl]carbamate Traditional Name: N-[2-(azepan-1-ium-1-yl)acetyl]carbamic acid methyl ester Formula: C10H19N2O3+ MolecularWeight: 215.26946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C[NH+]1CCCCCC1

Isomeric SMILES

COC(=O)NC(=O)C[NH+]1CCCCCC1

InChI

InChI=1S/C10H18N2O3/c1-15-10(14)11-9(13)8-12-6-4-2-3-5-7-12/h2-8H2,1H3,(H,11,13,14)/p+1