N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1H-indazole-3-carboxamide

Systemtic Name: N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1H-indazole-3-carboxamide Openeye Name: N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1H-indazole-3-carboxamide CAS Name: N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-5-methyl-1H-indazole-3-carboxamide IUPAC Name: N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1H-indazole-3-carboxamide Traditional Name: N-ethyl-N-[[(3R)-1-[2-(3-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1H-indazole-3-carboxamide Formula: C26H35N4O2+ MolecularWeight: 435.5817

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCC[NH+](C1)CCC2=CC(=CC=C2)OC)C(=O)C3=NNC4=C3C=C(C=C4)C

Isomeric SMILES

CCN(C[C@H]1CCC[NH+](C1)CCC2=CC(=CC=C2)OC)C(=O)C3=NNC4=C3C=C(C=C4)C

InChI

InChI=1S/C26H34N4O2/c1-4-30(26(31)25-23-15-19(2)10-11-24(23)27-28-25)18-21-8-6-13-29(17-21)14-12-20-7-5-9-22(16-20)32-3/h5,7,9-11,15-16,21H,4,6,8,12-14,17-18H2,1-3H3,(H,27,28)/p+1/t21-/m0/s1