tert-butyl-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: tert-butyl-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]-[(4-methylphenyl)methyl]azanium Openeye Name: tert-butyl-[[5-(isopentylcarbamoyl)-2-furyl]methyl]-(p-tolylmethyl)ammonium CAS Name: tert-butyl-[[5-[(3-methylbutylamino)-oxomethyl]-2-furanyl]methyl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: tert-butyl-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]-[(4-methylphenyl)methyl]azanium Traditional Name: tert-butyl-[[5-(isoamylcarbamoyl)-2-furyl]methyl]-(4-methylbenzyl)ammonium Formula: C23H35N2O2+ MolecularWeight: 371.5362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](CC2=CC=C(O2)C(=O)NCCC(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](CC2=CC=C(O2)C(=O)NCCC(C)C)C(C)(C)C

InChI

InChI=1S/C23H34N2O2/c1-17(2)13-14-24-22(26)21-12-11-20(27-21)16-25(23(4,5)6)15-19-9-7-18(3)8-10-19/h7-12,17H,13-16H2,1-6H3,(H,24,26)/p+1