(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-phenylquinoline-4-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-phenylquinoline-4-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid (1-propyltetrazol-5-yl)methyl ester Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2/c1-2-12-26-20(23-24-25-26)14-28-21(27)17-13-19(15-8-4-3-5-9-15)22-18-11-7-6-10-16(17)18/h3-11,13H,2,12,14H2,1H3