[(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(2-phenoxyethyl)azanium

Systemtic Name: [(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(2-phenoxyethyl)azanium Openeye Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl]-(2-phenoxyethyl)ammonium CAS Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-(2-phenoxyethyl)ammonium IUPAC Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-(2-phenoxyethyl)azanium Traditional Name: [(1S)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl]-(2-phenoxyethyl)ammonium Formula: C24H27N2O2+ MolecularWeight: 375.48338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)[NH2+]CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CCOC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O2/c1-18-13-14-19(2)22(17-18)26-24(27)23(20-9-5-3-6-10-20)25-15-16-28-21-11-7-4-8-12-21/h3-14,17,23,25H,15-16H2,1-2H3,(H,26,27)/p+1/t23-/m0/s1