5-tert-butyl-2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]furan-3-carboxamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]furan-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-tert-butyl-2-methyl-furan-3-carboxamide CAS Name: 5-tert-butyl-2-methyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-furancarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-tert-butyl-2-methylfuran-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-tert-butyl-2-methyl-3-furamide Formula: C22H31N2O2+ MolecularWeight: 355.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(C)(C)C)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(O1)C(C)(C)C)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2/c1-16-19(14-20(26-16)22(2,3)4)21(25)23-18-10-12-24(13-11-18)15-17-8-6-5-7-9-17/h5-9,14,18H,10-13,15H2,1-4H3,(H,23,25)/p+1