[(1S)-2-methyl-1-phenyl-propyl]-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]azanium

Systemtic Name: [(1S)-2-methyl-1-phenyl-propyl]-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]azanium Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium CAS Name: [(1S)-2-methyl-1-phenylpropyl]-[2-oxo-2-(2-propan-2-ylanilino)ethyl]ammonium IUPAC Name: [(1S)-2-methyl-1-phenylpropyl]-[2-oxo-2-(2-propan-2-ylanilino)ethyl]azanium Traditional Name: [2-(2-isopropylanilino)-2-keto-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C[NH2+]C(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C[NH2+][C@H](C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H28N2O/c1-15(2)18-12-8-9-13-19(18)23-20(24)14-22-21(16(3)4)17-10-6-5-7-11-17/h5-13,15-16,21-22H,14H2,1-4H3,(H,23,24)/p+1/t21-/m0/s1