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

Systemtic Name: methyl 4-methyl-2-[[4-(1,2,3,4-tetrazol-1-yl)phenoxy]methyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[4-(tetrazol-1-yl)phenoxy]methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[4-(1-tetrazolyl)phenoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[4-(tetrazol-1-yl)phenoxy]methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[4-(tetrazol-1-yl)phenoxy]methyl]quinoline-3-carboxylic acid methyl ester Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC3=CC=C(C=C3)N4C=NN=N4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC3=CC=C(C=C3)N4C=NN=N4)C(=O)OC

InChI

InChI=1S/C20H17N5O3/c1-13-16-5-3-4-6-17(16)22-18(19(13)20(26)27-2)11-28-15-9-7-14(8-10-15)25-12-21-23-24-25/h3-10,12H,11H2,1-2H3