(3-chloranyl-1-benzothiophen-2-yl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C17H11ClN4O2S MolecularWeight: 370.81284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)COC(=O)C3=CC(=CC=C3)N4C=NN=N4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)COC(=O)C3=CC(=CC=C3)N4C=NN=N4)Cl

InChI

InChI=1S/C17H11ClN4O2S/c18-16-13-6-1-2-7-14(13)25-15(16)9-24-17(23)11-4-3-5-12(8-11)22-10-19-20-21-22/h1-8,10H,9H2