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

Systemtic Name: [1-(2-ethyl-5-methyl-1,3-dioxan-5-yl)-3-naphthalen-1-yl-2-(1,2,4-triazol-1-yl)propyl] ethanoate Openeye Name: [1-(2-ethyl-5-methyl-1,3-dioxan-5-yl)-3-(1-naphthyl)-2-(1,2,4-triazol-1-yl)propyl] acetate CAS Name: acetic acid [1-(2-ethyl-5-methyl-1,3-dioxan-5-yl)-3-(1-naphthalenyl)-2-(1,2,4-triazol-1-yl)propyl] ester IUPAC Name: [1-(2-ethyl-5-methyl-1,3-dioxan-5-yl)-3-naphthalen-1-yl-2-(1,2,4-triazol-1-yl)propyl] acetate Traditional Name: acetic acid [1-(2-ethyl-5-methyl-1,3-dioxan-5-yl)-3-(1-naphthyl)-2-(1,2,4-triazol-1-yl)propyl] ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1OCC(CO1)(C)C(C(CC2=CC=CC3=CC=CC=C32)N4C=NC=N4)OC(=O)C

Isomeric SMILES

CCC1OCC(CO1)(C)C(C(CC2=CC=CC3=CC=CC=C32)N4C=NC=N4)OC(=O)C

InChI

InChI=1S/C24H29N3O4/c1-4-22-29-13-24(3,14-30-22)23(31-17(2)28)21(27-16-25-15-26-27)12-19-10-7-9-18-8-5-6-11-20(18)19/h5-11,15-16,21-23H,4,12-14H2,1-3H3