2-[(4-tert-butylphenyl)methyl-cyclopentyl-azaniumyl]ethanoate

Systemtic Name: 2-[(4-tert-butylphenyl)methyl-cyclopentyl-azaniumyl]ethanoate Openeye Name: 2-[(4-tert-butylphenyl)methyl-cyclopentyl-ammonio]acetate CAS Name: 2-[(4-tert-butylphenyl)methyl-cyclopentylammonio]acetate IUPAC Name: 2-[(4-tert-butylphenyl)methyl-cyclopentylazaniumyl]acetate Traditional Name: 2-[(4-tert-butylbenzyl)-cyclopentyl-ammonio]acetate Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](CC(=O)[O-])C2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](CC(=O)[O-])C2CCCC2

InChI

InChI=1S/C18H27NO2/c1-18(2,3)15-10-8-14(9-11-15)12-19(13-17(20)21)16-6-4-5-7-16/h8-11,16H,4-7,12-13H2,1-3H3,(H,20,21)