quinolin-8-ylmethyl 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: quinolin-8-ylmethyl 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: 8-quinolylmethyl 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid 8-quinolylmethyl ester Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)COC(=O)C3=CC(=CC=C3)N4C=NN=N4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)COC(=O)C3=CC(=CC=C3)N4C=NN=N4)N=CC=C2

InChI

InChI=1S/C18H13N5O2/c24-18(14-5-2-8-16(10-14)23-12-20-21-22-23)25-11-15-6-1-4-13-7-3-9-19-17(13)15/h1-10,12H,11H2