(3S)-N-(2-methyl-5-phenyl-pyrazol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(2-methyl-5-phenyl-pyrazol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(2-methyl-5-phenyl-pyrazol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-(2-methyl-5-phenyl-3-pyrazolyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(2-methyl-5-phenylpyrazol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(2-methyl-5-phenyl-pyrazol-3-yl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H17N3O3/c1-22-18(11-14(21-22)13-7-3-2-4-8-13)20-19(23)17-12-24-15-9-5-6-10-16(15)25-17/h2-11,17H,12H2,1H3,(H,20,23)/t17-/m0/s1