(2S)-2-azaniumyl-2-(4-chlorophenyl)butanoate

Systemtic Name: (2S)-2-azaniumyl-2-(4-chlorophenyl)butanoate Openeye Name: (2S)-2-azaniumyl-2-(4-chlorophenyl)butanoate CAS Name: (2S)-2-ammonio-2-(4-chlorophenyl)butanoate IUPAC Name: (2S)-2-azaniumyl-2-(4-chlorophenyl)butanoate Traditional Name: (2S)-2-ammonio-2-(4-chlorophenyl)butyrate Formula: C10H12ClNO2 MolecularWeight: 213.66078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Cl)(C(=O)[O-])[NH3+]

Isomeric SMILES

CC[C@](C1=CC=C(C=C1)Cl)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C10H12ClNO2/c1-2-10(12,9(13)14)7-3-5-8(11)6-4-7/h3-6H,2,12H2,1H3,(H,13,14)/t10-/m0/s1