ethyl 1-[1-(4-bromanylphenoxy)-2-oxidanyl-3-(1,2,4-triazol-1-yl)propan-2-yl]cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[1-(4-bromanylphenoxy)-2-oxidanyl-3-(1,2,4-triazol-1-yl)propan-2-yl]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[1-[(4-bromophenoxy)methyl]-1-hydroxy-2-(1,2,4-triazol-1-yl)ethyl]cyclopropanecarboxylate CAS Name: 1-[1-(4-bromophenoxy)-2-hydroxy-3-(1,2,4-triazol-1-yl)propan-2-yl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-bromophenoxy)-2-hydroxy-3-(1,2,4-triazol-1-yl)propan-2-yl]cyclopropane-1-carboxylate Traditional Name: 1-[1-[(4-bromophenoxy)methyl]-1-hydroxy-2-(1,2,4-triazol-1-yl)ethyl]cyclopropanecarboxylic acid ethyl ester Formula: C17H20BrN3O4 MolecularWeight: 410.2624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1)C(CN2C=NC=N2)(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

CCOC(=O)C1(CC1)C(CN2C=NC=N2)(COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C17H20BrN3O4/c1-2-24-15(22)16(7-8-16)17(23,9-21-12-19-11-20-21)10-25-14-5-3-13(18)4-6-14/h3-6,11-12,23H,2,7-10H2,1H3