(2S)-N-(3-ethanoylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: (2S)-N-(3-ethanoylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: (2S)-N-(3-acetylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: (2S)-N-(3-acetylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: (2S)-N-(3-acetylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: (2S)-N-(3-acetylphenyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C25H25N2O2+ MolecularWeight: 385.4782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H24N2O2/c1-18(28)21-12-7-13-23(16-21)26-25(29)24(20-9-3-2-4-10-20)27-15-14-19-8-5-6-11-22(19)17-27/h2-13,16,24H,14-15,17H2,1H3,(H,26,29)/p+1/t24-/m0/s1