1-(heptoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium

Systemtic Name: 1-(heptoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium Openeye Name: 1-benzyl-3-(heptoxymethyl)benzimidazol-1-ium CAS Name: 1-(heptoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium IUPAC Name: 1-benzyl-3-(heptoxymethyl)benzimidazol-1-ium Traditional Name: 1-benzyl-3-(heptoxymethyl)benzimidazol-1-ium Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCOCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N2O/c1-2-3-4-5-11-16-25-19-24-18-23(17-20-12-7-6-8-13-20)21-14-9-10-15-22(21)24/h6-10,12-15,18H,2-5,11,16-17,19H2,1H3/q+1