[5-(4-methoxy-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl] propanoate

Systemtic Name: [5-(4-methoxy-1-benzothiophen-2-yl)-1,2,3,4-tetrazol-1-yl] propanoate Openeye Name: [5-(4-methoxybenzothiophen-2-yl)tetrazol-1-yl] propanoate CAS Name: propanoic acid [5-(4-methoxy-1-benzothiophen-2-yl)-1-tetrazolyl] ester IUPAC Name: [5-(4-methoxy-1-benzothiophen-2-yl)tetrazol-1-yl] propanoate Traditional Name: propionic acid [5-(4-methoxybenzothiophen-2-yl)tetrazol-1-yl] ester Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1C(=NN=N1)C2=CC3=C(C=CC=C3S2)OC

Isomeric SMILES

CCC(=O)ON1C(=NN=N1)C2=CC3=C(C=CC=C3S2)OC

InChI

InChI=1S/C13H12N4O3S/c1-3-12(18)20-17-13(14-15-16-17)11-7-8-9(19-2)5-4-6-10(8)21-11/h4-7H,3H2,1-2H3