1-(5-methyl-1,3-dioxan-5-yl)-3-naphthalen-1-yl-2-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(5-methyl-1,3-dioxan-5-yl)-3-naphthalen-1-yl-2-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(5-methyl-1,3-dioxan-5-yl)-3-(1-naphthyl)-2-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(5-methyl-1,3-dioxan-5-yl)-3-(1-naphthalenyl)-2-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(5-methyl-1,3-dioxan-5-yl)-3-naphthalen-1-yl-2-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(5-methyl-1,3-dioxan-5-yl)-3-(1-naphthyl)-2-(1,2,4-triazol-1-yl)propan-1-one Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCOC1)C(=O)C(CC2=CC=CC3=CC=CC=C32)N4C=NC=N4

Isomeric SMILES

CC1(COCOC1)C(=O)C(CC2=CC=CC3=CC=CC=C32)N4C=NC=N4

InChI

InChI=1S/C20H21N3O3/c1-20(10-25-14-26-11-20)19(24)18(23-13-21-12-22-23)9-16-7-4-6-15-5-2-3-8-17(15)16/h2-8,12-13,18H,9-11,14H2,1H3