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

Systemtic Name: 2,2-dimethyl-5-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Openeye Name: 2,2-dimethyl-5-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one CAS Name: 2,2-dimethyl-5-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one IUPAC Name: 2,2-dimethyl-5-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Traditional Name: 2,2-dimethyl-5-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-one Formula: C14H15N3O3 MolecularWeight: 273.2872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3/c1-13(2)19-12(18)14(20-13,8-17-10-15-9-16-17)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3