N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide

Systemtic Name: N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide Openeye Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide CAS Name: N-[5-methyl-2-(phenylmethyl)-3-pyrazolyl]-2,3-dihydro-1,4-dioxin-5-carboxamide IUPAC Name: N-(2-benzyl-5-methylpyrazol-3-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide Traditional Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-2,3-dihydro-p-dioxin-5-carboxamide Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=COCCO2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=COCCO2)CC3=CC=CC=C3

InChI

InChI=1S/C16H17N3O3/c1-12-9-15(17-16(20)14-11-21-7-8-22-14)19(18-12)10-13-5-3-2-4-6-13/h2-6,9,11H,7-8,10H2,1H3,(H,17,20)