(3-tert-butyl-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(2-methoxyphenyl)carbonyl-carbamate

Systemtic Name: (3-tert-butyl-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(2-methoxyphenyl)carbonyl-carbamate Openeye Name: (3-tert-butyl-4-tetradecoxy-phenyl)methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(2-methoxybenzoyl)carbamate CAS Name: N-[(1-ethyl-4-pyridin-1-iumyl)methyl]-N-[(2-methoxyphenyl)-oxomethyl]carbamic acid (3-tert-butyl-4-tetradecoxyphenyl)methyl ester IUPAC Name: (3-tert-butyl-4-tetradecoxyphenyl)methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(2-methoxybenzoyl)carbamate Traditional Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-o-anisoyl-carbamic acid (3-tert-butyl-4-myristyloxy-benzyl) ester Formula: C42H61N2O5+ MolecularWeight: 673.94414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC)C(C)(C)C

InChI

InChI=1S/C42H61N2O5/c1-7-9-10-11-12-13-14-15-16-17-18-21-30-48-39-25-24-35(31-37(39)42(3,4)5)33-49-41(46)44(32-34-26-28-43(8-2)29-27-34)40(45)36-22-19-20-23-38(36)47-6/h19-20,22-29,31H,7-18,21,30,32-33H2,1-6H3/q+1