7-(1,3-benzothiazol-2-yl)heptanoic acid

Systemtic Name: 7-(1,3-benzothiazol-2-yl)heptanoic acid Openeye Name: 7-(1,3-benzothiazol-2-yl)heptanoic acid CAS Name: 7-(1,3-benzothiazol-2-yl)heptanoic acid IUPAC Name: 7-(1,3-benzothiazol-2-yl)heptanoic acid Traditional Name: 7-(1,3-benzothiazol-2-yl)enanthic acid Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2S/c16-14(17)10-4-2-1-3-9-13-15-11-7-5-6-8-12(11)18-13/h5-8H,1-4,9-10H2,(H,16,17)