[3-[9-(5-methoxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethyl-azanium iodide

Systemtic Name: [3-[9-(5-methoxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethyl-azanium iodide Openeye Name: [3-[9-(5-methoxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethyl-ammonium iodide CAS Name: [3-[9-(5-methoxy-1-indolyl)nonoxy-oxomethyl]phenyl]-trimethylammonium iodide IUPAC Name: [3-[9-(5-methoxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethylazanium iodide Traditional Name: [3-[9-(5-methoxyindol-1-yl)nonoxycarbonyl]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=CC(=C1)C(=O)OCCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

InChI

InChI=1S/C28H39N2O3.HI/c1-30(2,3)25-14-12-13-24(21-25)28(31)33-20-11-9-7-5-6-8-10-18-29-19-17-23-22-26(32-4)15-16-27(23)29;/h12-17,19,21-22H,5-11,18,20H2,1-4H3;1H/q+1;/p-1