[(2S)-1-[ethyl-(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]-(4-ethylphenyl)azanium

Systemtic Name: [(2S)-1-[ethyl-(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]-(4-ethylphenyl)azanium Openeye Name: [(1S)-2-(N-ethyl-3-methyl-anilino)-1-methyl-2-oxo-ethyl]-(4-ethylphenyl)ammonium CAS Name: [(2S)-1-(N-ethyl-3-methylanilino)-1-oxopropan-2-yl]-(4-ethylphenyl)ammonium IUPAC Name: [(2S)-1-(N-ethyl-3-methylanilino)-1-oxopropan-2-yl]-(4-ethylphenyl)azanium Traditional Name: [(1S)-2-(N-ethyl-3-methyl-anilino)-2-keto-1-methyl-ethyl]-(4-ethylphenyl)ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)[NH2+]C(C)C(=O)N(CC)C2=CC=CC(=C2)C

Isomeric SMILES

CCC1=CC=C(C=C1)[NH2+][C@@H](C)C(=O)N(CC)C2=CC=CC(=C2)C

InChI

InChI=1S/C20H26N2O/c1-5-17-10-12-18(13-11-17)21-16(4)20(23)22(6-2)19-9-7-8-15(3)14-19/h7-14,16,21H,5-6H2,1-4H3/p+1/t16-/m0/s1