2-[cycloheptyl-[(2-methylphenyl)methyl]azaniumyl]ethanoate

Systemtic Name: 2-[cycloheptyl-[(2-methylphenyl)methyl]azaniumyl]ethanoate Openeye Name: 2-[cycloheptyl(o-tolylmethyl)ammonio]acetate CAS Name: 2-[cycloheptyl-[(2-methylphenyl)methyl]ammonio]acetate IUPAC Name: 2-[cycloheptyl-[(2-methylphenyl)methyl]azaniumyl]acetate Traditional Name: 2-[cycloheptyl-(2-methylbenzyl)ammonio]acetate Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](CC(=O)[O-])C2CCCCCC2

Isomeric SMILES

CC1=CC=CC=C1C[NH+](CC(=O)[O-])C2CCCCCC2

InChI

InChI=1S/C17H25NO2/c1-14-8-6-7-9-15(14)12-18(13-17(19)20)16-10-4-2-3-5-11-16/h6-9,16H,2-5,10-13H2,1H3,(H,19,20)