4,4-dimethyl-1-[(1R)-1-phenyl-2-(phenylsulfinyl)ethyl]-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium

Systemtic Name: 4,4-dimethyl-1-[(1R)-1-phenyl-2-(phenylsulfinyl)ethyl]-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium Openeye Name: 1-[(1R)-2-(benzenesulfinyl)-1-phenyl-ethyl]-4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium CAS Name: 1-[(1R)-2-(benzenesulfinyl)-1-phenylethyl]-4,4-dimethyl-2-[(phenylseleno)methyl]-2,3-dihydropyrrol-1-ium IUPAC Name: 1-[(1R)-2-(benzenesulfinyl)-1-phenylethyl]-4,4-dimethyl-2-(phenylselanylmethyl)-2,3-dihydropyrrol-1-ium Traditional Name: 1-[(1R)-2-(benzenesulfinyl)-1-phenyl-ethyl]-4,4-dimethyl-2-[(phenylseleno)methyl]-1-pyrrolin-1-ium Formula: C27H30NOSSe+ MolecularWeight: 495.5582

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC([N+](=C1)C(CS(=O)C2=CC=CC=C2)C3=CC=CC=C3)C[Se]C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC([N+](=C1)[C@@H](CS(=O)C2=CC=CC=C2)C3=CC=CC=C3)C[Se]C4=CC=CC=C4)C

InChI

InChI=1S/C27H30NOSSe/c1-27(2)18-23(20-31-25-16-10-5-11-17-25)28(21-27)26(22-12-6-3-7-13-22)19-30(29)24-14-8-4-9-15-24/h3-17,21,23,26H,18-20H2,1-2H3/q+1/t23?,26-,30?/m0/s1