methyl 2-[4-[3-[1-(cyclohexylmethyl)-5-oxidanylidene-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propanoate

Systemtic Name: methyl 2-[4-[3-[1-(cyclohexylmethyl)-5-oxidanylidene-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propanoate Openeye Name: methyl 2-[4-[3-[1-(cyclohexylmethyl)-5-oxo-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propanoate CAS Name: 2-[4-[3-[1-(cyclohexylmethyl)-5-oxo-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[4-[3-[1-(cyclohexylmethyl)-5-oxo-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methylpropanoate Traditional Name: 2-[4-[3-[1-(cyclohexylmethyl)-5-keto-4-propyl-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propionic acid methyl ester Formula: C26H39N3O4 MolecularWeight: 457.60556

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=O)CC2CCCCC2)CCCC3=CC=C(C=C3)OC(C)(C)C(=O)OC

Isomeric SMILES

CCCN1C(=NN(C1=O)CC2CCCCC2)CCCC3=CC=C(C=C3)OC(C)(C)C(=O)OC

InChI

InChI=1S/C26H39N3O4/c1-5-18-28-23(27-29(25(28)31)19-21-10-7-6-8-11-21)13-9-12-20-14-16-22(17-15-20)33-26(2,3)24(30)32-4/h14-17,21H,5-13,18-19H2,1-4H3