dimethyl-[(2S)-2-phenyl-2-[[4-(propan-2-yloxymethyl)phenyl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-phenyl-2-[[4-(propan-2-yloxymethyl)phenyl]carbonylamino]ethyl]azanium Openeye Name: [(2S)-2-[[4-(isopropoxymethyl)benzoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: dimethyl-[(2S)-2-[[oxo-[4-(propan-2-yloxymethyl)phenyl]methyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-phenyl-2-[[4-(propan-2-yloxymethyl)benzoyl]amino]ethyl]azanium Traditional Name: [(2S)-2-[[4-(isopropoxymethyl)benzoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=C(C=C1)C(=O)NC(C[NH+](C)C)C2=CC=CC=C2

Isomeric SMILES

CC(C)OCC1=CC=C(C=C1)C(=O)N[C@H](C[NH+](C)C)C2=CC=CC=C2

InChI

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