[1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] propanoate

Systemtic Name: [1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] propanoate Openeye Name: [1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] propanoate CAS Name: propanoic acid [1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] ester IUPAC Name: [1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] propanoate Traditional Name: propionic acid [1-(5-methyl-1,3-dioxan-5-yl)-3-phenyl-2-(1,2,4-triazol-1-yl)propyl] ester Formula: C19H25N3O4 MolecularWeight: 359.4195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C(CC1=CC=CC=C1)N2C=NC=N2)C3(COCOC3)C

Isomeric SMILES

CCC(=O)OC(C(CC1=CC=CC=C1)N2C=NC=N2)C3(COCOC3)C

InChI

InChI=1S/C19H25N3O4/c1-3-17(23)26-18(19(2)10-24-14-25-11-19)16(22-13-20-12-21-22)9-15-7-5-4-6-8-15/h4-8,12-13,16,18H,3,9-11,14H2,1-2H3