N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]pyrazol-3-yl]pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]pyrazol-3-yl]pyridin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]pyrazol-3-yl]pyridin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]-3-pyrazolyl]-1-pyridin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]pyrazol-3-yl]pyridin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[3-[2-[(3-phenylcyclohexyl)methyl]pyrazol-3-yl]pyridin-1-ium-1-yl]acetamide Formula: C26H31N4O+ MolecularWeight: 415.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)C2=CC=CC=C2)CN3C(=CC=N3)C4=C[N+](=CC=C4)CC(=O)NC5CC5

Isomeric SMILES

C1CC(CC(C1)C2=CC=CC=C2)CN3C(=CC=N3)C4=C[N+](=CC=C4)CC(=O)NC5CC5

InChI

InChI=1S/C26H30N4O/c31-26(28-24-11-12-24)19-29-15-5-10-23(18-29)25-13-14-27-30(25)17-20-6-4-9-22(16-20)21-7-2-1-3-8-21/h1-3,5,7-8,10,13-15,18,20,22,24H,4,6,9,11-12,16-17,19H2/p+1