ethanoyl-[(3S)-1-phenethylpyrrolidin-3-yl]-diphenyl-azanium

Systemtic Name: ethanoyl-[(3S)-1-phenethylpyrrolidin-3-yl]-diphenyl-azanium Openeye Name: acetyl-[(3S)-1-phenethylpyrrolidin-3-yl]-diphenyl-ammonium CAS Name: acetyl-[(3S)-1-phenethyl-3-pyrrolidinyl]-diphenylammonium IUPAC Name: acetyl-[(3S)-1-phenethylpyrrolidin-3-yl]-diphenylazanium Traditional Name: acetyl-[(3S)-1-phenethylpyrrolidin-3-yl]-diphenyl-ammonium Formula: C26H29N2O+ MolecularWeight: 385.52126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+](C1CCN(C1)CCC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)[N+]([C@H]1CCN(C1)CCC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N2O/c1-22(29)28(24-13-7-3-8-14-24,25-15-9-4-10-16-25)26-18-20-27(21-26)19-17-23-11-5-2-6-12-23/h2-16,26H,17-21H2,1H3/q+1/t26-/m0/s1