trimethyl-[3-[6-(5-phenylmethoxyindol-1-yl)hexoxycarbonyl]phenyl]azanium

Systemtic Name: trimethyl-[3-[6-(5-phenylmethoxyindol-1-yl)hexoxycarbonyl]phenyl]azanium Openeye Name: [3-[6-(5-benzyloxyindol-1-yl)hexoxycarbonyl]phenyl]-trimethyl-ammonium CAS Name: trimethyl-[3-[oxo-[6-(5-phenylmethoxy-1-indolyl)hexoxy]methyl]phenyl]ammonium IUPAC Name: trimethyl-[3-[6-(5-phenylmethoxyindol-1-yl)hexoxycarbonyl]phenyl]azanium Traditional Name: [3-[6-(5-benzoxyindol-1-yl)hexoxycarbonyl]phenyl]-trimethyl-ammonium Formula: C31H37N2O3+ MolecularWeight: 485.63708

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C31H37N2O3/c1-33(2,3)28-15-11-14-27(22-28)31(34)35-21-10-5-4-9-19-32-20-18-26-23-29(16-17-30(26)32)36-24-25-12-7-6-8-13-25/h6-8,11-18,20,22-23H,4-5,9-10,19,21,24H2,1-3H3/q+1