1-(1,2-diethyl-5-phenyl-pyrazol-3-ylidene)piperidin-1-ium

Systemtic Name: 1-(1,2-diethyl-5-phenyl-pyrazol-3-ylidene)piperidin-1-ium Openeye Name: 1-(1,2-diethyl-5-phenyl-pyrazol-3-ylidene)piperidin-1-ium CAS Name: 1-(1,2-diethyl-5-phenyl-3-pyrazolylidene)piperidin-1-ium IUPAC Name: 1-(1,2-diethyl-5-phenylpyrazol-3-ylidene)piperidin-1-ium Traditional Name: 1-(1,2-diethyl-5-phenyl-3-pyrazolin-3-ylidene)piperidin-1-ium Formula: C18H26N3+ MolecularWeight: 284.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=[N+]2CCCCC2)N1CC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=CC(=[N+]2CCCCC2)N1CC)C3=CC=CC=C3

InChI

InChI=1S/C18H26N3/c1-3-20-17(16-11-7-5-8-12-16)15-18(21(20)4-2)19-13-9-6-10-14-19/h5,7-8,11-12,15H,3-4,6,9-10,13-14H2,1-2H3/q+1