2-[4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methyl]-1-piperazine-1,4-diiumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[(1-butyl-5-chloro-3-methylpyrazol-4-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide Formula: C18H32ClN5O+2 MolecularWeight: 369.93258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3CC3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3CC3)Cl

InChI

InChI=1S/C18H30ClN5O/c1-3-4-7-24-18(19)16(14(2)21-24)12-22-8-10-23(11-9-22)13-17(25)20-15-5-6-15/h15H,3-13H2,1-2H3,(H,20,25)/p+2