2-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-(1-methylpyrazol-4-yl)-1-phenyl-propan-1-one

Systemtic Name: 2-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]-3-(1-methylpyrazol-4-yl)-1-phenyl-propan-1-one Openeye Name: 2-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-3-(1-methylpyrazol-4-yl)-1-phenyl-propan-1-one CAS Name: 2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-3-(1-methyl-4-pyrazolyl)-1-phenyl-1-propanone IUPAC Name: 2-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-3-(1-methylpyrazol-4-yl)-1-phenylpropan-1-one Traditional Name: 2-[2-hydroxy-3-(4-methylpiperazino)propoxy]-3-(1-methylpyrazol-4-yl)-1-phenyl-propan-1-one Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(COC(CC2=CN(N=C2)C)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CN1CCN(CC1)CC(COC(CC2=CN(N=C2)C)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H30N4O3/c1-23-8-10-25(11-9-23)15-19(26)16-28-20(12-17-13-22-24(2)14-17)21(27)18-6-4-3-5-7-18/h3-7,13-14,19-20,26H,8-12,15-16H2,1-2H3