5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one

Systemtic Name: 5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Openeye Name: 5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one CAS Name: 5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one IUPAC Name: 5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Traditional Name: 5-(4-bromophenyl)-2,2-dimethyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(O1)(CN2C=NC=N2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1(OC(=O)C(O1)(CN2C=NC=N2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C14H14BrN3O3/c1-13(2)20-12(19)14(21-13,7-18-9-16-8-17-18)10-3-5-11(15)6-4-10/h3-6,8-9H,7H2,1-2H3