(4-ethylphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium

Systemtic Name: (4-ethylphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium Openeye Name: [(1R)-2-(benzylamino)-1-methyl-2-oxo-ethyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: (4-ethylphenyl)methyl-methyl-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]ammonium IUPAC Name: [(2R)-1-(benzylamino)-1-oxopropan-2-yl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)C(C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)[C@H](C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O/c1-4-17-10-12-19(13-11-17)15-22(3)16(2)20(23)21-14-18-8-6-5-7-9-18/h5-13,16H,4,14-15H2,1-3H3,(H,21,23)/p+1/t16-/m1/s1