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

Systemtic Name: [4-bromanyl-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl] N-ethylcarbamate Openeye Name: [3-bromo-2,2-dimethyl-1-[(4-phenylphenoxy)-(1,2,4-triazol-1-yl)methyl]propyl] N-ethylcarbamate CAS Name: N-ethylcarbamic acid [4-bromo-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl] ester IUPAC Name: [4-bromo-3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-yl] N-ethylcarbamate Traditional Name: N-ethylcarbamic acid [3-bromo-2,2-dimethyl-1-[(4-phenylphenoxy)-(1,2,4-triazol-1-yl)methyl]propyl] ester Formula: C23H27BrN4O3 MolecularWeight: 487.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27BrN4O3/c1-4-26-22(29)31-20(23(2,3)14-24)21(28-16-25-15-27-28)30-19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13,15-16,20-21H,4,14H2,1-3H3,(H,26,29)