[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]-(4-iodophenyl)azanium

Systemtic Name: [(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]-(4-iodophenyl)azanium Openeye Name: [(1S)-2-(diethylamino)-1-methyl-2-oxo-ethyl]-(4-iodophenyl)ammonium CAS Name: [(2S)-1-(diethylamino)-1-oxopropan-2-yl]-(4-iodophenyl)ammonium IUPAC Name: [(2S)-1-(diethylamino)-1-oxopropan-2-yl]-(4-iodophenyl)azanium Traditional Name: [(1S)-2-(diethylamino)-2-keto-1-methyl-ethyl]-(4-iodophenyl)ammonium Formula: C13H20IN2O+ MolecularWeight: 347.21517

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)[NH2+]C1=CC=C(C=C1)I

Isomeric SMILES

CCN(CC)C(=O)[C@H](C)[NH2+]C1=CC=C(C=C1)I

InChI

InChI=1S/C13H19IN2O/c1-4-16(5-2)13(17)10(3)15-12-8-6-11(14)7-9-12/h6-10,15H,4-5H2,1-3H3/p+1/t10-/m0/s1