2-[(4-hexylphenyl)methyl-(4-methanoylphenyl)amino]ethyl-trimethyl-azanium

Systemtic Name: 2-[(4-hexylphenyl)methyl-(4-methanoylphenyl)amino]ethyl-trimethyl-azanium Openeye Name: 2-[4-formyl-N-[(4-hexylphenyl)methyl]anilino]ethyl-trimethyl-ammonium CAS Name: 2-[4-formyl-N-[(4-hexylphenyl)methyl]anilino]ethyl-trimethylammonium IUPAC Name: 2-[4-formyl-N-[(4-hexylphenyl)methyl]anilino]ethyl-trimethylazanium Traditional Name: 2-(4-formyl-N-(4-hexylbenzyl)anilino)ethyl-trimethyl-ammonium Formula: C25H37N2O+ MolecularWeight: 381.57408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)CN(CC[N+](C)(C)C)C2=CC=C(C=C2)C=O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)CN(CC[N+](C)(C)C)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C25H37N2O/c1-5-6-7-8-9-22-10-12-23(13-11-22)20-26(18-19-27(2,3)4)25-16-14-24(21-28)15-17-25/h10-17,21H,5-9,18-20H2,1-4H3/q+1