[5-butyl-3-(3-methylbutyl)-1,2,4-triazol-1-yl]methyl (2-phenylpyridin-4-yl) carbonate

Systemtic Name: [5-butyl-3-(3-methylbutyl)-1,2,4-triazol-1-yl]methyl (2-phenylpyridin-4-yl) carbonate Openeye Name: (5-butyl-3-isopentyl-1,2,4-triazol-1-yl)methyl (2-phenyl-4-pyridyl) carbonate CAS Name: carbonic acid [5-butyl-3-(3-methylbutyl)-1,2,4-triazol-1-yl]methyl (2-phenyl-4-pyridinyl) ester IUPAC Name: [5-butyl-3-(3-methylbutyl)-1,2,4-triazol-1-yl]methyl (2-phenylpyridin-4-yl) carbonate Traditional Name: carbonic acid (5-butyl-3-isoamyl-1,2,4-triazol-1-yl)methyl (2-phenyl-4-pyridyl) ester Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1COC(=O)OC2=CC(=NC=C2)C3=CC=CC=C3)CCC(C)C

Isomeric SMILES

CCCCC1=NC(=NN1COC(=O)OC2=CC(=NC=C2)C3=CC=CC=C3)CCC(C)C

InChI

InChI=1S/C24H30N4O3/c1-4-5-11-23-26-22(13-12-18(2)3)27-28(23)17-30-24(29)31-20-14-15-25-21(16-20)19-9-7-6-8-10-19/h6-10,14-16,18H,4-5,11-13,17H2,1-3H3