5-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(4-phenoxyphenyl)-4-phenyl-2-pyrazoline-1-carboxamide Formula: C29H23N3O4 MolecularWeight: 477.51062

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

Isomeric SMILES

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

InChI

InChI=1S/C29H23N3O4/c33-29(30-22-12-14-24(15-13-22)36-23-9-5-2-6-10-23)32-18-25(20-7-3-1-4-8-20)28(31-32)21-11-16-26-27(17-21)35-19-34-26/h1-17,25H,18-19H2,(H,30,33)