[(1R)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-ethoxypropyl)azanium

Systemtic Name: [(1R)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-ethoxypropyl)azanium Openeye Name: [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl]-(3-ethoxypropyl)ammonium CAS Name: [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-(3-ethoxypropyl)ammonium IUPAC Name: [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-(3-ethoxypropyl)azanium Traditional Name: [(1R)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl]-(3-ethoxypropyl)ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]C(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOCCC[NH2+][C@H](C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H28N2O2/c1-4-25-14-8-13-22-20(18-9-6-5-7-10-18)21(24)23-19-15-16(2)11-12-17(19)3/h5-7,9-12,15,20,22H,4,8,13-14H2,1-3H3,(H,23,24)/p+1/t20-/m1/s1