methyl 2-[3-butyl-5-oxidanylidene-4-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[3-butyl-5-oxidanylidene-4-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[3-butyl-5-oxo-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]-2-phenyl-acetate CAS Name: 2-[3-butyl-5-oxo-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[3-butyl-5-oxo-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]-2-phenylacetate Traditional Name: 2-[3-butyl-5-keto-4-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-1,2,4-triazol-1-yl]-2-phenyl-acetic acid methyl ester Formula: C29H29N7O3 MolecularWeight: 523.58566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C(C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C(C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H29N7O3/c1-3-4-14-25-32-36(26(28(37)39-2)22-10-6-5-7-11-22)29(38)35(25)19-20-15-17-21(18-16-20)23-12-8-9-13-24(23)27-30-33-34-31-27/h5-13,15-18,26H,3-4,14,19H2,1-2H3,(H,30,31,33,34)