[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(2-methylbutan-2-yl)azanium

Systemtic Name: [(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(2-methylbutan-2-yl)azanium Openeye Name: 1,1-dimethylpropyl-[(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]C(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCC(C)(C)[NH2+][C@@H](C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C21H28N2O2/c1-6-21(3,4)23-19(16-10-8-7-9-11-16)20(24)22-17-14-15(2)12-13-18(17)25-5/h7-14,19,23H,6H2,1-5H3,(H,22,24)/p+1/t19-/m0/s1