2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propanoic acid Openeye Name: 2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propanoic acid CAS Name: 2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propanoic acid IUPAC Name: 2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propanoic acid Traditional Name: 2-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]propionic acid Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=NC3=C(S2)CCCC3)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=NC3=C(S2)CCCC3)C(=O)O

InChI

InChI=1S/C16H17NO2S/c1-10(16(18)19)11-6-8-12(9-7-11)15-17-13-4-2-3-5-14(13)20-15/h6-10H,2-5H2,1H3,(H,18,19)