tert-butyl-(phenylmethyl)-[[5-[(phenylmethyl)carbamoyl]furan-2-yl]methyl]azanium

Systemtic Name: tert-butyl-(phenylmethyl)-[[5-[(phenylmethyl)carbamoyl]furan-2-yl]methyl]azanium Openeye Name: benzyl-[[5-(benzylcarbamoyl)-2-furyl]methyl]-tert-butyl-ammonium CAS Name: tert-butyl-[[5-[oxo-[(phenylmethyl)amino]methyl]-2-furanyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-(benzylcarbamoyl)furan-2-yl]methyl]-tert-butylazanium Traditional Name: benzyl-[[5-(benzylcarbamoyl)-2-furyl]methyl]-tert-butyl-ammonium Formula: C24H29N2O2+ MolecularWeight: 377.49926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH+](CC1=CC=CC=C1)CC2=CC=C(O2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)[NH+](CC1=CC=CC=C1)CC2=CC=C(O2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O2/c1-24(2,3)26(17-20-12-8-5-9-13-20)18-21-14-15-22(28-21)23(27)25-16-19-10-6-4-7-11-19/h4-15H,16-18H2,1-3H3,(H,25,27)/p+1