[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: [(1S)-1-(4-ethylphenyl)-2-methylpropyl]-[2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: [(1S)-1-(4-ethylphenyl)-2-methylpropyl]-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]azanium Traditional Name: [(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-[2-(2-furfurylcarbamoylamino)-2-keto-ethyl]ammonium Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)[NH2+]CC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)[NH2+]CC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C20H27N3O3/c1-4-15-7-9-16(10-8-15)19(14(2)3)21-13-18(24)23-20(25)22-12-17-6-5-11-26-17/h5-11,14,19,21H,4,12-13H2,1-3H3,(H2,22,23,24,25)/p+1/t19-/m0/s1