4-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-1,4-oxazepan-4-ium

Systemtic Name: 4-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-1,4-oxazepan-4-ium Openeye Name: 4-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]-1,4-oxazepan-4-ium CAS Name: 4-[1-[4-(1-pyrazolyl)phenyl]-4-piperidinyl]-1,4-oxazepan-4-ium IUPAC Name: 4-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-1,4-oxazepan-4-ium Traditional Name: 4-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]-1,4-oxazepan-4-ium Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCOC1)C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C[NH+](CCOC1)C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C19H26N4O/c1-9-20-23(11-1)19-5-3-17(4-6-19)22-12-7-18(8-13-22)21-10-2-15-24-16-14-21/h1,3-6,9,11,18H,2,7-8,10,12-16H2/p+1