[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Systemtic Name: [4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazino]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)C6=CC=CC=C6

InChI

InChI=1S/C26H26N4O4/c31-25(21-16-20(18-10-11-18)27-30(21)19-6-2-1-3-7-19)28-12-14-29(15-13-28)26(32)24-17-33-22-8-4-5-9-23(22)34-24/h1-9,16,18,24H,10-15,17H2