(2-methoxyphenyl)methyl-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: (2-methoxyphenyl)methyl-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[[5-(isopentylcarbamoyl)-2-furyl]methyl]-[(2-methoxyphenyl)methyl]ammonium CAS Name: (2-methoxyphenyl)methyl-[[5-[(3-methylbutylamino)-oxomethyl]-2-furanyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2-methoxyphenyl)methyl]-[[5-(3-methylbutylcarbamoyl)furan-2-yl]methyl]azanium Traditional Name: benzyl-[[5-(isoamylcarbamoyl)-2-furyl]methyl]-o-anisyl-ammonium Formula: C26H33N2O3+ MolecularWeight: 421.55182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3OC

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3OC

InChI

InChI=1S/C26H32N2O3/c1-20(2)15-16-27-26(29)25-14-13-23(31-25)19-28(17-21-9-5-4-6-10-21)18-22-11-7-8-12-24(22)30-3/h4-14,20H,15-19H2,1-3H3,(H,27,29)/p+1