(2R)-1-(2,3-dihydro-1H-inden-2-yl)-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(2,3-dihydro-1H-inden-2-yl)-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-indan-2-yl-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-(2,3-dihydro-1H-inden-2-yl)-N-[4-(1-pyrazolyl)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-(2,3-dihydro-1H-inden-2-yl)-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-indan-2-yl-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-2-carboxamide Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)NC2=CC=C(C=C2)N3C=CC=N3)C4CC5=CC=CC=C5C4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)NC2=CC=C(C=C2)N3C=CC=N3)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C24H26N4O/c29-24(26-20-9-11-21(12-10-20)28-15-5-13-25-28)23-8-3-4-14-27(23)22-16-18-6-1-2-7-19(18)17-22/h1-2,5-7,9-13,15,22-23H,3-4,8,14,16-17H2,(H,26,29)/p+1/t23-/m1/s1