(5R)-5-azaniumyl-5-(1-benzothiophen-3-yl)pentanoate

Systemtic Name: (5R)-5-azaniumyl-5-(1-benzothiophen-3-yl)pentanoate Openeye Name: (5R)-5-azaniumyl-5-(benzothiophen-3-yl)pentanoate CAS Name: (5R)-5-ammonio-5-(1-benzothiophen-3-yl)pentanoate IUPAC Name: (5R)-5-azaniumyl-5-(1-benzothiophen-3-yl)pentanoate Traditional Name: (5R)-5-ammonio-5-(benzothiophen-3-yl)valerate Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C(CCCC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)[C@@H](CCCC(=O)[O-])[NH3+]

InChI

InChI=1S/C13H15NO2S/c14-11(5-3-7-13(15)16)10-8-17-12-6-2-1-4-9(10)12/h1-2,4,6,8,11H,3,5,7,14H2,(H,15,16)/t11-/m1/s1