1-[[(1S)-cyclohex-3-en-1-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-N-[4-(1-pyrazolyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Formula: C22H29N4O+ MolecularWeight: 365.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H28N4O/c27-22(24-20-7-9-21(10-8-20)26-14-4-13-23-26)19-11-15-25(16-12-19)17-18-5-2-1-3-6-18/h1-2,4,7-10,13-14,18-19H,3,5-6,11-12,15-17H2,(H,24,27)/p+1/t18-/m1/s1