1-[(1-ethylpyrazol-4-yl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1-ethyl-4-pyrazolyl)methyl]-N-[4-(3-pyridinyloxy)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-4-carboxamide Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CN=CC=C4

Isomeric SMILES

CCN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CN=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-2-28-17-18(14-25-28)16-27-12-9-19(10-13-27)23(29)26-20-5-7-21(8-6-20)30-22-4-3-11-24-15-22/h3-8,11,14-15,17,19H,2,9-10,12-13,16H2,1H3,(H,26,29)/p+1