trimethyl-[4-[2-[7-(2-methylindol-1-yl)heptoxy]-2-oxidanylidene-ethyl]phenyl]azanium

Systemtic Name: trimethyl-[4-[2-[7-(2-methylindol-1-yl)heptoxy]-2-oxidanylidene-ethyl]phenyl]azanium Openeye Name: trimethyl-[4-[2-[7-(2-methylindol-1-yl)heptoxy]-2-oxo-ethyl]phenyl]ammonium CAS Name: trimethyl-[4-[2-[7-(2-methyl-1-indolyl)heptoxy]-2-oxoethyl]phenyl]ammonium IUPAC Name: trimethyl-[4-[2-[7-(2-methylindol-1-yl)heptoxy]-2-oxoethyl]phenyl]azanium Traditional Name: [4-[2-keto-2-[7-(2-methylindol-1-yl)heptoxy]ethyl]phenyl]-trimethyl-ammonium Formula: C27H37N2O2+ MolecularWeight: 421.59488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CCCCCCCOC(=O)CC3=CC=C(C=C3)[N+](C)(C)C

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CCCCCCCOC(=O)CC3=CC=C(C=C3)[N+](C)(C)C

InChI

InChI=1S/C27H37N2O2/c1-22-20-24-12-8-9-13-26(24)28(22)18-10-6-5-7-11-19-31-27(30)21-23-14-16-25(17-15-23)29(2,3)4/h8-9,12-17,20H,5-7,10-11,18-19,21H2,1-4H3/q+1