3-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-1H-indazole-5-carbonitrile

Systemtic Name: 3-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-1H-indazole-5-carbonitrile Openeye Name: 3-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]amino]-1H-indazole-5-carbonitrile CAS Name: 3-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]amino]-1H-indazole-5-carbonitrile IUPAC Name: 3-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-1H-indazole-5-carbonitrile Traditional Name: 3-[(1-piperonyl-4-piperidyl)amino]-1H-indazole-5-carbonitrile Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NNC3=C2C=C(C=C3)C#N)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1NC2=NNC3=C2C=C(C=C3)C#N)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N5O2/c22-11-14-1-3-18-17(9-14)21(25-24-18)23-16-5-7-26(8-6-16)12-15-2-4-19-20(10-15)28-13-27-19/h1-4,9-10,16H,5-8,12-13H2,(H2,23,24,25)