2-[5-(6-butoxy-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(6-butoxy-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl]ethanoic acid Openeye Name: 2-[5-(6-butoxybenzothiophen-2-yl)tetrazol-1-yl]acetic acid CAS Name: 2-[5-(6-butoxy-1-benzothiophen-2-yl)-1-tetrazolyl]acetic acid IUPAC Name: 2-[5-(6-butoxy-1-benzothiophen-2-yl)tetrazol-1-yl]acetic acid Traditional Name: 2-[5-(6-butoxybenzothiophen-2-yl)tetrazol-1-yl]acetic acid Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C=C(S2)C3=NN=NN3CC(=O)O

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C=C(S2)C3=NN=NN3CC(=O)O

InChI

InChI=1S/C15H16N4O3S/c1-2-3-6-22-11-5-4-10-7-13(23-12(10)8-11)15-16-17-18-19(15)9-14(20)21/h4-5,7-8H,2-3,6,9H2,1H3,(H,20,21)