(3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-3-yl)methyl]-N-(phenylcarbonyl)carbamate

Systemtic Name: (3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-3-yl)methyl]-N-(phenylcarbonyl)carbamate Openeye Name: (3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamate CAS Name: N-benzoyl-N-[(1-ethyl-3-pyridin-1-iumyl)methyl]carbamic acid (3,5-dimethoxy-4-tetradecoxyphenyl)methyl ester IUPAC Name: (3,5-dimethoxy-4-tetradecoxyphenyl)methyl N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamate Traditional Name: N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamic acid (3,5-dimethoxy-4-myristyloxy-benzyl) ester Formula: C39H55N2O6+ MolecularWeight: 647.8638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1OC)COC(=O)N(CC2=C[N+](=CC=C2)CC)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1OC)COC(=O)N(CC2=C[N+](=CC=C2)CC)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C39H55N2O6/c1-5-7-8-9-10-11-12-13-14-15-16-20-26-46-37-35(44-3)27-33(28-36(37)45-4)31-47-39(43)41(38(42)34-23-18-17-19-24-34)30-32-22-21-25-40(6-2)29-32/h17-19,21-25,27-29H,5-16,20,26,30-31H2,1-4H3/q+1