[(2S)-1-(dipropylamino)-1-oxidanylidene-propan-2-yl]-(2-methylphenyl)azanium

Systemtic Name: [(2S)-1-(dipropylamino)-1-oxidanylidene-propan-2-yl]-(2-methylphenyl)azanium Openeye Name: [(1S)-2-(dipropylamino)-1-methyl-2-oxo-ethyl]-(o-tolyl)ammonium CAS Name: [(2S)-1-(dipropylamino)-1-oxopropan-2-yl]-(2-methylphenyl)ammonium IUPAC Name: [(2S)-1-(dipropylamino)-1-oxopropan-2-yl]-(2-methylphenyl)azanium Traditional Name: [(1S)-2-(dipropylamino)-2-keto-1-methyl-ethyl]-(o-tolyl)ammonium Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(C)[NH2+]C1=CC=CC=C1C

Isomeric SMILES

CCCN(CCC)C(=O)[C@H](C)[NH2+]C1=CC=CC=C1C

InChI

InChI=1S/C16H26N2O/c1-5-11-18(12-6-2)16(19)14(4)17-15-10-8-7-9-13(15)3/h7-10,14,17H,5-6,11-12H2,1-4H3/p+1/t14-/m0/s1