methyl 1-ethyl-3-pentyl-2-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3H-pyrazole-5-carboxylate

Systemtic Name: methyl 1-ethyl-3-pentyl-2-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3H-pyrazole-5-carboxylate Openeye Name: methyl 1-ethyl-3-pentyl-2-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-3H-pyrazole-5-carboxylate CAS Name: 1-ethyl-3-pentyl-2-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-3H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3-pentyl-2-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-3H-pyrazole-5-carboxylate Traditional Name: 5-amyl-2-ethyl-1-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-3-pyrazoline-3-carboxylic acid methyl ester Formula: C25H30N6O2 MolecularWeight: 446.5447

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=C(N(N1C2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)CC)C(=O)OC

Isomeric SMILES

CCCCCC1C=C(N(N1C2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)CC)C(=O)OC

InChI

InChI=1S/C25H30N6O2/c1-4-6-8-13-19-17-23(25(32)33-3)30(5-2)31(19)20-14-15-21(18-11-9-7-10-12-18)22(16-20)24-26-28-29-27-24/h7,9-12,14-17,19H,4-6,8,13H2,1-3H3,(H,26,27,28,29)