ethyl N-[4-bromanyl-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl]oxycarbonylcarbamate

Systemtic Name: ethyl N-[4-bromanyl-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl]oxycarbonylcarbamate Openeye Name: ethyl N-[3-bromo-2,2-dimethyl-1-[(4-phenylphenoxy)-(1,2,4-triazol-1-yl)methyl]propoxy]carbonylcarbamate CAS Name: N-[[4-bromo-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl]oxy-oxomethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-bromo-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl]oxycarbonylcarbamate Traditional Name: N-[3-bromo-2,2-dimethyl-1-[(4-phenylphenoxy)-(1,2,4-triazol-1-yl)methyl]propoxy]carbonylcarbamic acid ethyl ester Formula: C24H27BrN4O5 MolecularWeight: 531.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)OC(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3)C(C)(C)CBr

Isomeric SMILES

CCOC(=O)NC(=O)OC(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3)C(C)(C)CBr

InChI

InChI=1S/C24H27BrN4O5/c1-4-32-22(30)28-23(31)34-20(24(2,3)14-25)21(29-16-26-15-27-29)33-19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13,15-16,20-21H,4,14H2,1-3H3,(H,28,30,31)