2-[(4-chlorophenyl)methyl-(phenylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[(4-chlorophenyl)methyl-(phenylmethyl)azaniumyl]ethanoate Openeye Name: 2-[benzyl-[(4-chlorophenyl)methyl]ammonio]acetate CAS Name: 2-[(4-chlorophenyl)methyl-(phenylmethyl)ammonio]acetate IUPAC Name: 2-[benzyl-[(4-chlorophenyl)methyl]azaniumyl]acetate Traditional Name: 2-[benzyl-(4-chlorobenzyl)ammonio]acetate Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO2/c17-15-8-6-14(7-9-15)11-18(12-16(19)20)10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,19,20)