[(2S)-2-cyanopropyl]-bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(2S)-2-cyanopropyl]-bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [(2S)-2-cyanopropyl]-bis[2-(2,6-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-2-cyanopropyl]-bis[2-(2,6-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: [(2S)-2-cyanopropyl]-bis[2-(2,6-dimethylanilino)-2-oxoethyl]azanium Traditional Name: [(2S)-2-cyanopropyl]-bis[2-(2,6-dimethylanilino)-2-keto-ethyl]ammonium Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CC(C)C#N)CC(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](C[C@H](C)C#N)CC(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C24H30N4O2/c1-16(12-25)13-28(14-21(29)26-23-17(2)8-6-9-18(23)3)15-22(30)27-24-19(4)10-7-11-20(24)5/h6-11,16H,13-15H2,1-5H3,(H,26,29)(H,27,30)/p+1/t16-/m1/s1