N-[(4R)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: N-[(4R)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide Openeye Name: N-[(4R)-6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-isopropylpiperidin-1-ium-4-yl)acetamide CAS Name: N-[(4R)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-propan-2-yl-4-piperidin-1-iumyl)acetamide IUPAC Name: N-[(4R)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-propan-2-ylpiperidin-1-ium-4-yl)acetamide Traditional Name: N-[(4R)-6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]-2-(1-isopropylpiperidin-1-ium-4-yl)acetamide Formula: C26H39N4O+ MolecularWeight: 423.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=N2)C(CC(C3)(C)C)NC(=O)CC4CC[NH+](CC4)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=N2)[C@@H](CC(C3)(C)C)NC(=O)CC4CC[NH+](CC4)C(C)C

InChI

InChI=1S/C26H38N4O/c1-18(2)29-12-10-20(11-13-29)14-25(31)28-22-15-26(4,5)16-24-21(22)17-27-30(24)23-9-7-6-8-19(23)3/h6-9,17-18,20,22H,10-16H2,1-5H3,(H,28,31)/p+1/t22-/m1/s1