2-[[3-(4-chlorophenyl)-3-oxidanylidene-propyl]azaniumyl]ethanoate

Systemtic Name: 2-[[3-(4-chlorophenyl)-3-oxidanylidene-propyl]azaniumyl]ethanoate Openeye Name: 2-[[3-(4-chlorophenyl)-3-oxo-propyl]ammonio]acetate CAS Name: 2-[[3-(4-chlorophenyl)-3-oxopropyl]ammonio]acetate IUPAC Name: 2-[[3-(4-chlorophenyl)-3-oxopropyl]azaniumyl]acetate Traditional Name: 2-[[3-(4-chlorophenyl)-3-keto-propyl]ammonio]acetate Formula: C11H12ClNO3 MolecularWeight: 241.67088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC[NH2+]CC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC[NH2+]CC(=O)[O-])Cl

InChI

InChI=1S/C11H12ClNO3/c12-9-3-1-8(2-4-9)10(14)5-6-13-7-11(15)16/h1-4,13H,5-7H2,(H,15,16)