2-[4-acetamido-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-acetamido-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[4-acetamido-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[4-acetamido-4-(4-methoxyphenyl)-1-piperidin-1-iumyl]-N-tert-butylacetamide IUPAC Name: 2-[4-acetamido-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]-N-tert-butylacetamide Traditional Name: 2-[4-acetamido-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]-N-tert-butyl-acetamide Formula: C20H32N3O3+ MolecularWeight: 362.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CC[NH+](CC1)CC(=O)NC(C)(C)C)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)NC1(CC[NH+](CC1)CC(=O)NC(C)(C)C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H31N3O3/c1-15(24)21-20(16-6-8-17(26-5)9-7-16)10-12-23(13-11-20)14-18(25)22-19(2,3)4/h6-9H,10-14H2,1-5H3,(H,21,24)(H,22,25)/p+1