1-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperazine

Systemtic Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperazine Openeye Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperazine CAS Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-4-pyrazolyl]methyl]-4-(2-methoxyethyl)piperazine IUPAC Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-phenylpyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperazine Traditional Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperazine Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

COCCN1CCN(CC1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C24H28N4O3/c1-29-14-13-26-9-11-27(12-10-26)16-20-17-28(21-5-3-2-4-6-21)25-24(20)19-7-8-22-23(15-19)31-18-30-22/h2-8,15,17H,9-14,16,18H2,1H3