2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-N-[(1-phenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)NCC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)NCC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O4/c30-25(19-10-11-23-24(14-19)33-13-12-32-23)21-8-4-5-9-22(21)26(31)27-15-18-16-28-29(17-18)20-6-2-1-3-7-20/h1-11,14,16-17H,12-13,15H2,(H,27,31)