[2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-[(1S)-1-phenylethyl]azanium

Systemtic Name: [2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-[(1S)-1-phenylethyl]azanium Openeye Name: [2-[2-(4-isopropylphenyl)ethylamino]-2-oxo-ethyl]-[(1S)-1-phenylethyl]ammonium CAS Name: [2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-[(1S)-1-phenylethyl]ammonium IUPAC Name: [2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-[(1S)-1-phenylethyl]azanium Traditional Name: [2-keto-2-(2-p-cumenylethylamino)ethyl]-[(1S)-1-phenylethyl]ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH2+]CC(=O)NCCC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H28N2O/c1-16(2)19-11-9-18(10-12-19)13-14-22-21(24)15-23-17(3)20-7-5-4-6-8-20/h4-12,16-17,23H,13-15H2,1-3H3,(H,22,24)/p+1/t17-/m0/s1