N-(3-tert-butyl-4-dodecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide

Systemtic Name: N-(3-tert-butyl-4-dodecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide Openeye Name: N-(3-tert-butyl-4-dodecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide CAS Name: N-(3-tert-butyl-4-dodecoxyphenyl)-N-[(1-methyl-2-pyridin-1-iumyl)methyl]acetamide IUPAC Name: N-(3-tert-butyl-4-dodecoxyphenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide Traditional Name: N-(3-tert-butyl-4-lauryloxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide Formula: C31H49N2O2+ MolecularWeight: 481.73296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2C)C(=O)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2C)C(=O)C)C(C)(C)C

InChI

InChI=1S/C31H49N2O2/c1-7-8-9-10-11-12-13-14-15-18-23-35-30-21-20-27(24-29(30)31(3,4)5)33(26(2)34)25-28-19-16-17-22-32(28)6/h16-17,19-22,24H,7-15,18,23,25H2,1-6H3/q+1