(3S)-3-azaniumyl-4-pyridin-4-yl-butanoate

Systemtic Name: (3S)-3-azaniumyl-4-pyridin-4-yl-butanoate Openeye Name: (3S)-3-azaniumyl-4-(4-pyridyl)butanoate CAS Name: (3S)-3-ammonio-4-pyridin-4-ylbutanoate IUPAC Name: (3S)-3-azaniumyl-4-pyridin-4-ylbutanoate Traditional Name: (3S)-3-ammonio-4-(4-pyridyl)butyrate Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CC(CC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CN=CC=C1C[C@@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C9H12N2O2/c10-8(6-9(12)13)5-7-1-3-11-4-2-7/h1-4,8H,5-6,10H2,(H,12,13)/t8-/m0/s1