2-[cyclohexyl-[(4-ethylphenyl)methyl]azaniumyl]ethanoate

Systemtic Name: 2-[cyclohexyl-[(4-ethylphenyl)methyl]azaniumyl]ethanoate Openeye Name: 2-[cyclohexyl-[(4-ethylphenyl)methyl]ammonio]acetate CAS Name: 2-[cyclohexyl-[(4-ethylphenyl)methyl]ammonio]acetate IUPAC Name: 2-[cyclohexyl-[(4-ethylphenyl)methyl]azaniumyl]acetate Traditional Name: 2-[cyclohexyl-(4-ethylbenzyl)ammonio]acetate Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](CC(=O)[O-])C2CCCCC2

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](CC(=O)[O-])C2CCCCC2

InChI

InChI=1S/C17H25NO2/c1-2-14-8-10-15(11-9-14)12-18(13-17(19)20)16-6-4-3-5-7-16/h8-11,16H,2-7,12-13H2,1H3,(H,19,20)