(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-phenyl-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-phenyl-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 1-benzyl-3-phenyl-pyrazole-4-carboxylate CAS Name: 3-phenyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 1-benzyl-3-phenylpyrazole-4-carboxylate Traditional Name: 1-benzyl-3-phenyl-pyrazole-4-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N6O2/c1-2-13-28-20(23-25-26-28)16-30-22(29)19-15-27(14-17-9-5-3-6-10-17)24-21(19)18-11-7-4-8-12-18/h3-12,15H,2,13-14,16H2,1H3