[(1S)-2-methyl-1-phenyl-propyl]-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(1S)-2-methyl-1-phenyl-propyl]-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(2-isopropyl-6-methyl-anilino)-2-oxo-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium CAS Name: [(1S)-2-methyl-1-phenylpropyl]-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]ammonium IUPAC Name: [(1S)-2-methyl-1-phenylpropyl]-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]azanium Traditional Name: [2-(2-isopropyl-6-methyl-anilino)-2-keto-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH2+]C(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH2+][C@H](C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C22H30N2O/c1-15(2)19-13-9-10-17(5)22(19)24-20(25)14-23-21(16(3)4)18-11-7-6-8-12-18/h6-13,15-16,21,23H,14H2,1-5H3,(H,24,25)/p+1/t21-/m0/s1