3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(pyrrolidin-1-ylmethyl)pyrazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(pyrrolidin-1-ylmethyl)pyrazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(pyrrolidin-1-ylmethyl)pyrazole CAS Name: 3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(1-pyrrolidinylmethyl)pyrazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(pyrrolidin-1-ylmethyl)pyrazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-phenyl-4-(pyrrolidinomethyl)pyrazole Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C21H21N3O2/c1-2-6-18(7-3-1)24-14-17(13-23-10-4-5-11-23)21(22-24)16-8-9-19-20(12-16)26-15-25-19/h1-3,6-9,12,14H,4-5,10-11,13,15H2