[4-[2-[8-(5-methoxyindol-1-yl)octoxy]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium iodide

Systemtic Name: [4-[2-[8-(5-methoxyindol-1-yl)octoxy]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium iodide Openeye Name: [4-[2-[8-(5-methoxyindol-1-yl)octoxy]-2-oxo-ethyl]phenyl]-trimethyl-ammonium iodide CAS Name: [4-[2-[8-(5-methoxy-1-indolyl)octoxy]-2-oxoethyl]phenyl]-trimethylammonium iodide IUPAC Name: [4-[2-[8-(5-methoxyindol-1-yl)octoxy]-2-oxoethyl]phenyl]-trimethylazanium iodide Traditional Name: [4-[2-keto-2-[8-(5-methoxyindol-1-yl)octoxy]ethyl]phenyl]-trimethyl-ammonium iodide Formula: C28H39IN2O3 MolecularWeight: 578.52533

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

InChI

InChI=1S/C28H39N2O3.HI/c1-30(2,3)25-13-11-23(12-14-25)21-28(31)33-20-10-8-6-5-7-9-18-29-19-17-24-22-26(32-4)15-16-27(24)29;/h11-17,19,22H,5-10,18,20-21H2,1-4H3;1H/q+1;/p-1