(3-ethanoylphenyl)methyl-[(3R)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]azanium

Systemtic Name: (3-ethanoylphenyl)methyl-[(3R)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]azanium Openeye Name: (3-acetylphenyl)methyl-[(3R)-5-oxo-1-phenethyl-pyrrolidin-3-yl]ammonium CAS Name: (3-acetylphenyl)methyl-[(3R)-5-oxo-1-phenethyl-3-pyrrolidinyl]ammonium IUPAC Name: (3-acetylphenyl)methyl-[(3R)-5-oxo-1-phenethylpyrrolidin-3-yl]azanium Traditional Name: (3-acetylbenzyl)-[(3R)-5-keto-1-phenethyl-pyrrolidin-3-yl]ammonium Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C[NH2+]C2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C[NH2+][C@@H]2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c1-16(24)19-9-5-8-18(12-19)14-22-20-13-21(25)23(15-20)11-10-17-6-3-2-4-7-17/h2-9,12,20,22H,10-11,13-15H2,1H3/p+1/t20-/m1/s1