5-azanyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 5-azanyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 5-amino-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 5-amino-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]methyl]-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 5-amino-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-1-methyl-2-phenylpyrazol-3-one Traditional Name: 5-amino-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]methyl]-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5)N

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5)N

InChI

InChI=1S/C23H27N5O3/c1-25-22(24)18(23(29)28(25)17-6-3-2-4-7-17)16-26-10-12-27(13-11-26)19-8-5-9-20-21(19)31-15-14-30-20/h2-9H,10-16,24H2,1H3