(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (1-butyltetrazol-5-yl)methyl ester Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C17H19N5O2/c1-3-4-9-22-16(19-20-21-22)11-24-17(23)14-10-12(2)18-15-8-6-5-7-13(14)15/h5-8,10H,3-4,9,11H2,1-2H3