dimethyl 2-bromanyl-5-[4-(1-hydroxyethyl)-1,2,3-triazol-1-yl]hexanedioate

Systemtic Name: dimethyl 2-bromanyl-5-[4-(1-hydroxyethyl)-1,2,3-triazol-1-yl]hexanedioate Openeye Name: dimethyl 2-bromo-5-[4-(1-hydroxyethyl)triazol-1-yl]hexanedioate CAS Name: 2-bromo-5-[4-(1-hydroxyethyl)-1-triazolyl]hexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-bromo-5-[4-(1-hydroxyethyl)triazol-1-yl]hexanedioate Traditional Name: 2-bromo-5-[4-(1-hydroxyethyl)triazol-1-yl]adipic acid dimethyl ester Formula: C12H18BrN3O5 MolecularWeight: 364.19242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(N=N1)C(CCC(C(=O)OC)Br)C(=O)OC)O

Isomeric SMILES

CC(C1=CN(N=N1)C(CCC(C(=O)OC)Br)C(=O)OC)O

InChI

InChI=1S/C12H18BrN3O5/c1-7(17)9-6-16(15-14-9)10(12(19)21-3)5-4-8(13)11(18)20-2/h6-8,10,17H,4-5H2,1-3H3