1-[5-(1,3-benzodioxol-5-yl)-3-(1-methylpyrrol-2-yl)-3,4-dihydropyrazol-2-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[5-(1,3-benzodioxol-5-yl)-3-(1-methylpyrrol-2-yl)-3,4-dihydropyrazol-2-yl]-2-phenoxy-ethanone Openeye Name: 1-[5-(1,3-benzodioxol-5-yl)-3-(1-methylpyrrol-2-yl)-3,4-dihydropyrazol-2-yl]-2-phenoxy-ethanone CAS Name: 1-[5-(1,3-benzodioxol-5-yl)-3-(1-methyl-2-pyrrolyl)-3,4-dihydropyrazol-2-yl]-2-phenoxyethanone IUPAC Name: 1-[5-(1,3-benzodioxol-5-yl)-3-(1-methylpyrrol-2-yl)-3,4-dihydropyrazol-2-yl]-2-phenoxyethanone Traditional Name: 1-[3-(1,3-benzodioxol-5-yl)-5-(1-methylpyrrol-2-yl)-2-pyrazolin-1-yl]-2-phenoxy-ethanone Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CC(=NN2C(=O)COC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=CC=C1C2CC(=NN2C(=O)COC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21N3O4/c1-25-11-5-8-19(25)20-13-18(16-9-10-21-22(12-16)30-15-29-21)24-26(20)23(27)14-28-17-6-3-2-4-7-17/h2-12,20H,13-15H2,1H3