tert-butyl-[(2-methylphenyl)methyl]-[[5-(pentylcarbamoyl)furan-2-yl]methyl]azanium

Systemtic Name: tert-butyl-[(2-methylphenyl)methyl]-[[5-(pentylcarbamoyl)furan-2-yl]methyl]azanium Openeye Name: tert-butyl-(o-tolylmethyl)-[[5-(pentylcarbamoyl)-2-furyl]methyl]ammonium CAS Name: tert-butyl-[(2-methylphenyl)methyl]-[[5-[oxo-(pentylamino)methyl]-2-furanyl]methyl]ammonium IUPAC Name: tert-butyl-[(2-methylphenyl)methyl]-[[5-(pentylcarbamoyl)furan-2-yl]methyl]azanium Traditional Name: [5-(amylcarbamoyl)-2-furyl]methyl-tert-butyl-(2-methylbenzyl)ammonium Formula: C23H35N2O2+ MolecularWeight: 371.5362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2C)C(C)(C)C

Isomeric SMILES

CCCCCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2C)C(C)(C)C

InChI

InChI=1S/C23H34N2O2/c1-6-7-10-15-24-22(26)21-14-13-20(27-21)17-25(23(3,4)5)16-19-12-9-8-11-18(19)2/h8-9,11-14H,6-7,10,15-17H2,1-5H3,(H,24,26)/p+1