methyl 4-methyl-2-[2-(1,2,3,4-tetrazol-1-yl)ethanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[2-(1,2,3,4-tetrazol-1-yl)ethanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[2-(tetrazol-1-yl)acetyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-(1-tetrazolyl)ethoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(tetrazol-1-yl)acetyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[2-(tetrazol-1-yl)acetyl]oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C16H15N5O4 MolecularWeight: 341.3214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3C=NN=N3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3C=NN=N3)C(=O)OC

InChI

InChI=1S/C16H15N5O4/c1-10-11-5-3-4-6-12(11)18-13(15(10)16(23)24-2)8-25-14(22)7-21-9-17-19-20-21/h3-6,9H,7-8H2,1-2H3