N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

Systemtic Name: N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Openeye Name: N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide CAS Name: N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]-4-piperidin-1-iumyl]-3-pyrazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Traditional Name: N-[2-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Formula: C21H35N4O+ MolecularWeight: 359.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)C[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)C3CC3

Isomeric SMILES

C[C@H](CCC=C(C)C)C[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)C3CC3

InChI

InChI=1S/C21H34N4O/c1-16(2)5-4-6-17(3)15-24-13-10-19(11-14-24)25-20(9-12-22-25)23-21(26)18-7-8-18/h5,9,12,17-19H,4,6-8,10-11,13-15H2,1-3H3,(H,23,26)/p+1/t17-/m1/s1