(3-methoxy-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-3-yl)methyl]-N-(phenylcarbonyl)carbamate iodide

Systemtic Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-3-yl)methyl]-N-(phenylcarbonyl)carbamate iodide Openeye Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamate iodide CAS Name: N-benzoyl-N-[(1-ethyl-3-pyridin-1-iumyl)methyl]carbamic acid (3-methoxy-4-tetradecoxyphenyl)methyl ester iodide IUPAC Name: (3-methoxy-4-tetradecoxyphenyl)methyl N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamate iodide Traditional Name: N-benzoyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]carbamic acid (3-methoxy-4-myristyloxy-benzyl) ester iodide Formula: C38H53IN2O5 MolecularWeight: 744.74229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=C[N+](=CC=C2)CC)C(=O)C3=CC=CC=C3)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=C[N+](=CC=C2)CC)C(=O)C3=CC=CC=C3)OC.[I-]

InChI

InChI=1S/C38H53N2O5.HI/c1-4-6-7-8-9-10-11-12-13-14-15-19-27-44-35-25-24-32(28-36(35)43-3)31-45-38(42)40(37(41)34-22-17-16-18-23-34)30-33-21-20-26-39(5-2)29-33;/h16-18,20-26,28-29H,4-15,19,27,30-31H2,1-3H3;1H/q+1;/p-1