[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]azanium

Systemtic Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]azanium Openeye Name: [(1S)-2-methyl-1-phenyl-propyl]-[2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl]-[(1S)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl]-[(1S)-2-methyl-1-phenylpropyl]azanium Traditional Name: [2-keto-2-[2-(o-tolyl)ethylamino]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:

CC1=CC=CC=C1CCNC(=O)C[NH2+]C(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)C[NH2+][C@H](C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H28N2O/c1-16(2)21(19-11-5-4-6-12-19)23-15-20(24)22-14-13-18-10-8-7-9-17(18)3/h4-12,16,21,23H,13-15H2,1-3H3,(H,22,24)/p+1/t21-/m0/s1