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

Systemtic Name: (3S)-3-azaniumyl-4-thiophen-3-yl-butanoate Openeye Name: (3S)-3-azaniumyl-4-(3-thienyl)butanoate CAS Name: (3S)-3-ammonio-4-(3-thiophenyl)butanoate IUPAC Name: (3S)-3-azaniumyl-4-thiophen-3-ylbutanoate Traditional Name: (3S)-3-ammonio-4-(3-thienyl)butyrate Formula: C8H11NO2S MolecularWeight: 185.24344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO2S/c9-7(4-8(10)11)3-6-1-2-12-5-6/h1-2,5,7H,3-4,9H2,(H,10,11)/t7-/m0/s1