[(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [(1R)-2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [(1R)-2-(4-cyanoanilino)-2-keto-1-methyl-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)[NH+](C)CCOC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C#N)[NH+](C)CCOC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O2/c1-15(19(23)21-17-10-8-16(14-20)9-11-17)22(2)12-13-24-18-6-4-3-5-7-18/h3-11,15H,12-13H2,1-2H3,(H,21,23)/p+1/t15-/m1/s1