[4-[7-(5-methoxyindol-1-yl)heptoxycarbonyl]phenyl]-trimethyl-azanium iodide

Systemtic Name: [4-[7-(5-methoxyindol-1-yl)heptoxycarbonyl]phenyl]-trimethyl-azanium iodide Openeye Name: [4-[7-(5-methoxyindol-1-yl)heptoxycarbonyl]phenyl]-trimethyl-ammonium iodide CAS Name: [4-[7-(5-methoxy-1-indolyl)heptoxy-oxomethyl]phenyl]-trimethylammonium iodide IUPAC Name: [4-[7-(5-methoxyindol-1-yl)heptoxycarbonyl]phenyl]-trimethylazanium iodide Traditional Name: [4-[7-(5-methoxyindol-1-yl)heptoxycarbonyl]phenyl]-trimethyl-ammonium iodide Formula: C26H35IN2O3 MolecularWeight: 550.47217

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)C(=O)OCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)C(=O)OCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

InChI

InChI=1S/C26H35N2O3.HI/c1-28(2,3)23-12-10-21(11-13-23)26(29)31-19-9-7-5-6-8-17-27-18-16-22-20-24(30-4)14-15-25(22)27;/h10-16,18,20H,5-9,17,19H2,1-4H3;1H/q+1;/p-1