[1-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]piperidin-4-yl]-(2-pyrazol-1-ylethyl)azanium

Systemtic Name: [1-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]piperidin-4-yl]-(2-pyrazol-1-ylethyl)azanium Openeye Name: [1-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]-4-piperidyl]-(2-pyrazol-1-ylethyl)ammonium CAS Name: [1-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-4-piperidinyl]-[2-(1-pyrazolyl)ethyl]ammonium IUPAC Name: [1-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]piperidin-4-yl]-(2-pyrazol-1-ylethyl)azanium Traditional Name: [1-[4-(piperonyloylamino)phenyl]-4-piperidyl]-(2-pyrazol-1-ylethyl)ammonium Formula: C24H28N5O3+ MolecularWeight: 434.51082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCN2C=CC=N2)C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1[NH2+]CCN2C=CC=N2)C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N5O3/c30-24(18-2-7-22-23(16-18)32-17-31-22)27-20-3-5-21(6-4-20)28-13-8-19(9-14-28)25-11-15-29-12-1-10-26-29/h1-7,10,12,16,19,25H,8-9,11,13-15,17H2,(H,27,30)/p+1