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

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-propan-2-ylquinoline-4-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid (1-butyltetrazol-5-yl)methyl ester Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5O2/c1-4-5-10-24-18(21-22-23-24)12-26-19(25)15-11-17(13(2)3)20-16-9-7-6-8-14(15)16/h6-9,11,13H,4-5,10,12H2,1-3H3