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

Systemtic Name: [3-(2,4-dichlorophenyl)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)propyl] ethanoate Openeye Name: [3-(2,4-dichlorophenyl)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)propyl] acetate CAS Name: acetic acid [3-(2,4-dichlorophenyl)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)propyl] ester IUPAC Name: [3-(2,4-dichlorophenyl)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)propyl] acetate Traditional Name: acetic acid [3-(2,4-dichlorophenyl)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)propyl] ester Formula: C18H21Cl2N3O4 MolecularWeight: 414.28304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21Cl2N3O4/c1-12(24)27-17(18(2)7-25-11-26-8-18)16(23-10-21-9-22-23)5-13-3-4-14(19)6-15(13)20/h3-4,6,9-10,16-17H,5,7-8,11H2,1-2H3