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

Systemtic Name: [1-[4-(furan-2-yl)phenyl]piperidin-4-yl]-(3-pyrazol-1-ylpropyl)azanium Openeye Name: [1-[4-(2-furyl)phenyl]-4-piperidyl]-(3-pyrazol-1-ylpropyl)ammonium CAS Name: [1-[4-(2-furanyl)phenyl]-4-piperidinyl]-[3-(1-pyrazolyl)propyl]ammonium IUPAC Name: [1-[4-(furan-2-yl)phenyl]piperidin-4-yl]-(3-pyrazol-1-ylpropyl)azanium Traditional Name: [1-[4-(2-furyl)phenyl]-4-piperidyl]-(3-pyrazol-1-ylpropyl)ammonium Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCCN2C=CC=N2)C3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

C1CN(CCC1[NH2+]CCCN2C=CC=N2)C3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C21H26N4O/c1-4-21(26-17-1)18-5-7-20(8-6-18)24-15-9-19(10-16-24)22-11-2-13-25-14-3-12-23-25/h1,3-8,12,14,17,19,22H,2,9-11,13,15-16H2/p+1