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

Systemtic Name: methyl 4-methyl-2-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[4-(tetrazol-1-yl)benzoyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[oxo-[4-(1-tetrazolyl)phenyl]methoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[4-(tetrazol-1-yl)benzoyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[4-(tetrazol-1-yl)benzoyl]oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N5O4/c1-13-16-5-3-4-6-17(16)23-18(19(13)21(28)29-2)11-30-20(27)14-7-9-15(10-8-14)26-12-22-24-25-26/h3-10,12H,11H2,1-2H3