N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=NN(C=C3C4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=NN(C=C3C4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O5/c1-17(18-9-12-23-25(13-18)35-16-34-23)28-27(31)26-21(15-30(29-26)20-7-5-4-6-8-20)19-10-11-22(32-2)24(14-19)33-3/h4-15,17H,16H2,1-3H3,(H,28,31)