2-[(2-chlorophenyl)methyl-propan-2-yl-azaniumyl]ethanoate

Systemtic Name: 2-[(2-chlorophenyl)methyl-propan-2-yl-azaniumyl]ethanoate Openeye Name: 2-[(2-chlorophenyl)methyl-isopropyl-ammonio]acetate CAS Name: 2-[(2-chlorophenyl)methyl-propan-2-ylammonio]acetate IUPAC Name: 2-[(2-chlorophenyl)methyl-propan-2-ylazaniumyl]acetate Traditional Name: 2-[(2-chlorobenzyl)-isopropyl-ammonio]acetate Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1Cl)CC(=O)[O-]

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1Cl)CC(=O)[O-]

InChI

InChI=1S/C12H16ClNO2/c1-9(2)14(8-12(15)16)7-10-5-3-4-6-11(10)13/h3-6,9H,7-8H2,1-2H3,(H,15,16)