1-[5-azanyl-1,4,6-trimethyl-3-(3-tetradecoxyphenyl)pyridin-1-ium-2-yl]ethanone

Systemtic Name: 1-[5-azanyl-1,4,6-trimethyl-3-(3-tetradecoxyphenyl)pyridin-1-ium-2-yl]ethanone Openeye Name: 1-[5-amino-1,4,6-trimethyl-3-(3-tetradecoxyphenyl)pyridin-1-ium-2-yl]ethanone CAS Name: 1-[5-amino-1,4,6-trimethyl-3-(3-tetradecoxyphenyl)-2-pyridin-1-iumyl]ethanone IUPAC Name: 1-[5-amino-1,4,6-trimethyl-3-(3-tetradecoxyphenyl)pyridin-1-ium-2-yl]ethanone Traditional Name: 1-[5-amino-1,4,6-trimethyl-3-(3-myristyloxyphenyl)pyridin-1-ium-2-yl]ethanone Formula: C30H47N2O2+ MolecularWeight: 467.70638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1)C2=C(C(=C([N+](=C2C(=O)C)C)C)N)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1)C2=C(C(=C([N+](=C2C(=O)C)C)C)N)C

InChI

InChI=1S/C30H46N2O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-34-27-20-18-19-26(22-27)28-23(2)29(31)24(3)32(5)30(28)25(4)33/h18-20,22H,6-17,21H2,1-5H3,(H-,31,33)/p+1