2-(3,5-ditert-butylphenyl)carbonyloxyethyl-methyl-(phenylmethyl)azanium

Systemtic Name: 2-(3,5-ditert-butylphenyl)carbonyloxyethyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(3,5-ditert-butylbenzoyl)oxyethyl]-methyl-ammonium CAS Name: 2-[(3,5-ditert-butylphenyl)-oxomethoxy]ethyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(3,5-ditert-butylbenzoyl)oxyethyl]-methylazanium Traditional Name: benzyl-[2-(3,5-ditert-butylbenzoyl)oxyethyl]-methyl-ammonium Formula: C25H36NO2+ MolecularWeight: 382.55884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC[NH+](C)CC2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC[NH+](C)CC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C25H35NO2/c1-24(2,3)21-15-20(16-22(17-21)25(4,5)6)23(27)28-14-13-26(7)18-19-11-9-8-10-12-19/h8-12,15-17H,13-14,18H2,1-7H3/p+1