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

Systemtic Name: trimethyl-[3-[9-(5-phenylmethoxyindol-1-yl)nonoxycarbonyl]phenyl]azanium iodide Openeye Name: [3-[9-(5-benzyloxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethyl-ammonium iodide CAS Name: trimethyl-[3-[oxo-[9-(5-phenylmethoxy-1-indolyl)nonoxy]methyl]phenyl]ammonium iodide IUPAC Name: trimethyl-[3-[9-(5-phenylmethoxyindol-1-yl)nonoxycarbonyl]phenyl]azanium iodide Traditional Name: [3-[9-(5-benzoxyindol-1-yl)nonoxycarbonyl]phenyl]-trimethyl-ammonium iodide Formula: C34H43IN2O3 MolecularWeight: 654.62129

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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)OCC4=CC=CC=C4.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4.[I-]

InChI

InChI=1S/C34H43N2O3.HI/c1-36(2,3)31-18-14-17-30(25-31)34(37)38-24-13-8-6-4-5-7-12-22-35-23-21-29-26-32(19-20-33(29)35)39-27-28-15-10-9-11-16-28;/h9-11,14-21,23,25-26H,4-8,12-13,22,24,27H2,1-3H3;1H/q+1;/p-1