1-[4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]carbonyl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]carbonyl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carbonyl]piperazino]-3-methyl-butan-1-one Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H26N4O4/c1-14(2)11-19(26)24-5-7-25(8-6-24)21(27)16-13-22-23-20(16)15-3-4-17-18(12-15)29-10-9-28-17/h3-4,12-14H,5-11H2,1-2H3,(H,22,23)