2-[(2-chlorophenyl)methyl-(furan-2-ylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[(2-chlorophenyl)methyl-(furan-2-ylmethyl)azaniumyl]ethanoate Openeye Name: 2-[(2-chlorophenyl)methyl-(2-furylmethyl)ammonio]acetate CAS Name: 2-[(2-chlorophenyl)methyl-(2-furanylmethyl)ammonio]acetate IUPAC Name: 2-[(2-chlorophenyl)methyl-(furan-2-ylmethyl)azaniumyl]acetate Traditional Name: 2-[(2-chlorobenzyl)-(2-furfuryl)ammonio]acetate Formula: C14H14ClNO3 MolecularWeight: 279.71886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[NH+](CC2=CC=CO2)CC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C[NH+](CC2=CC=CO2)CC(=O)[O-])Cl

InChI

InChI=1S/C14H14ClNO3/c15-13-6-2-1-4-11(13)8-16(10-14(17)18)9-12-5-3-7-19-12/h1-7H,8-10H2,(H,17,18)