N-(2-chlorophenyl)-3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[1-[(1-ethyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C20H28ClN4O+ MolecularWeight: 375.91552

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CCN1C=C(C=N1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C20H27ClN4O/c1-2-25-15-17(13-22-25)14-24-11-9-16(10-12-24)7-8-20(26)23-19-6-4-3-5-18(19)21/h3-6,13,15-16H,2,7-12,14H2,1H3,(H,23,26)/p+1