(3-chloranyl-4-tetradecoxy-phenyl)methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate

Systemtic Name: (3-chloranyl-4-tetradecoxy-phenyl)methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate Openeye Name: (3-chloro-4-tetradecoxy-phenyl)methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate CAS Name: N-acetyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]carbamic acid (3-chloro-4-tetradecoxyphenyl)methyl ester IUPAC Name: (3-chloro-4-tetradecoxyphenyl)methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate Traditional Name: N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamic acid (3-chloro-4-myristyloxy-benzyl) ester Formula: C31H46ClN2O4+ MolecularWeight: 546.16094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)Cl

InChI

InChI=1S/C31H46ClN2O4/c1-4-5-6-7-8-9-10-11-12-13-14-17-22-37-30-20-19-27(23-29(30)32)25-38-31(36)34(26(2)35)24-28-18-15-16-21-33(28)3/h15-16,18-21,23H,4-14,17,22,24-25H2,1-3H3/q+1