4-(1,3-benzodioxol-5-yl)-N-[4-(4-chloranylphenoxy)phenyl]-5-phenyl-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-[4-(4-chloranylphenoxy)phenyl]-5-phenyl-3,4-dihydropyrazole-2-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-[4-(4-chlorophenoxy)phenyl]-5-phenyl-3,4-dihydropyrazole-2-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yl)-N-[4-(4-chlorophenoxy)phenyl]-5-phenyl-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-[4-(4-chlorophenoxy)phenyl]-5-phenyl-3,4-dihydropyrazole-2-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yl)-N-[4-(4-chlorophenoxy)phenyl]-3-phenyl-2-pyrazoline-1-carboxamide Formula: C29H22ClN3O4 MolecularWeight: 511.95568

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H22ClN3O4/c30-21-7-11-23(12-8-21)37-24-13-9-22(10-14-24)31-29(34)33-17-25(28(32-33)19-4-2-1-3-5-19)20-6-15-26-27(16-20)36-18-35-26/h1-16,25H,17-18H2,(H,31,34)