[1-[3-(2-cyclopentylethanoylamino)phenyl]piperidin-4-yl]-(3-pyrazol-1-ylpropyl)azanium

Systemtic Name: [1-[3-(2-cyclopentylethanoylamino)phenyl]piperidin-4-yl]-(3-pyrazol-1-ylpropyl)azanium Openeye Name: [1-[3-[(2-cyclopentylacetyl)amino]phenyl]-4-piperidyl]-(3-pyrazol-1-ylpropyl)ammonium CAS Name: [1-[3-[(2-cyclopentyl-1-oxoethyl)amino]phenyl]-4-piperidinyl]-[3-(1-pyrazolyl)propyl]ammonium IUPAC Name: [1-[3-[(2-cyclopentylacetyl)amino]phenyl]piperidin-4-yl]-(3-pyrazol-1-ylpropyl)azanium Traditional Name: [1-[3-[(2-cyclopentylacetyl)amino]phenyl]-4-piperidyl]-(3-pyrazol-1-ylpropyl)ammonium Formula: C24H36N5O+ MolecularWeight: 410.57554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CCCN4C=CC=N4

Isomeric SMILES

C1CCC(C1)CC(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CCCN4C=CC=N4

InChI

InChI=1S/C24H35N5O/c30-24(18-20-6-1-2-7-20)27-22-8-3-9-23(19-22)28-16-10-21(11-17-28)25-12-4-14-29-15-5-13-26-29/h3,5,8-9,13,15,19-21,25H,1-2,4,6-7,10-12,14,16-18H2,(H,27,30)/p+1