(4-tert-butylphenyl)methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-(2-furfurylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C20H27N3O3/c1-20(2,3)16-9-7-15(8-10-16)13-23(4)14-18(24)22-19(25)21-12-17-6-5-11-26-17/h5-11H,12-14H2,1-4H3,(H2,21,22,24,25)/p+1