(3S)-3-azanyl-4-(1-benzothiophen-2-yl)butanoic acid

Systemtic Name: (3S)-3-azanyl-4-(1-benzothiophen-2-yl)butanoic acid Openeye Name: (3S)-3-amino-4-(benzothiophen-2-yl)butanoic acid CAS Name: (3S)-3-amino-4-(1-benzothiophen-2-yl)butanoic acid IUPAC Name: (3S)-3-amino-4-(1-benzothiophen-2-yl)butanoic acid Traditional Name: (3S)-3-amino-4-(benzothiophen-2-yl)butyric acid Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)CC(CC(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C[C@H](CC(=O)O)N

InChI

InChI=1S/C12H13NO2S/c13-9(7-12(14)15)6-10-5-8-3-1-2-4-11(8)16-10/h1-5,9H,6-7,13H2,(H,14,15)/t9-/m1/s1