[4-(hexadecoxymethyl)oxolan-2-yl]methyl N-ethanoyl-N-(1-ethylpyridin-1-ium-3-yl)carbamate

Systemtic Name: [4-(hexadecoxymethyl)oxolan-2-yl]methyl N-ethanoyl-N-(1-ethylpyridin-1-ium-3-yl)carbamate Openeye Name: [4-(hexadecoxymethyl)tetrahydrofuran-2-yl]methyl N-acetyl-N-(1-ethylpyridin-1-ium-3-yl)carbamate CAS Name: N-acetyl-N-(1-ethyl-3-pyridin-1-iumyl)carbamic acid [4-(hexadecoxymethyl)-2-oxolanyl]methyl ester IUPAC Name: [4-(hexadecoxymethyl)oxolan-2-yl]methyl N-acetyl-N-(1-ethylpyridin-1-ium-3-yl)carbamate Traditional Name: N-acetyl-N-(1-ethylpyridin-1-ium-3-yl)carbamic acid [4-(cetyloxymethyl)tetrahydrofuran-2-yl]methyl ester Formula: C32H55N2O5+ MolecularWeight: 547.7895

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)N(C2=C[N+](=CC=C2)CC)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)N(C2=C[N+](=CC=C2)CC)C(=O)C

InChI

InChI=1S/C32H55N2O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-37-25-29-23-31(38-26-29)27-39-32(36)34(28(3)35)30-20-19-21-33(5-2)24-30/h19-21,24,29,31H,4-18,22-23,25-27H2,1-3H3/q+1