5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[3-(phenylcarbamoyl)phenyl]methyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[3-(phenylcarbamoyl)phenyl]methyl]-1H-pyrazole-4-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[3-(phenylcarbamoyl)phenyl]methyl]-1H-pyrazole-4-carboxamide CAS Name: N-[[3-[anilino(oxo)methyl]phenyl]methyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[3-(phenylcarbamoyl)phenyl]methyl]-1H-pyrazole-4-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(phenylcarbamoyl)benzyl]-1H-pyrazole-4-carboxamide Formula: C26H22N4O4 MolecularWeight: 454.47728

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCC4=CC=CC(=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCC4=CC=CC(=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O4/c31-25(29-20-7-2-1-3-8-20)19-6-4-5-17(13-19)15-27-26(32)21-16-28-30-24(21)18-9-10-22-23(14-18)34-12-11-33-22/h1-10,13-14,16H,11-12,15H2,(H,27,32)(H,28,30)(H,29,31)