[(1R,2S,6S)-2,6-diphenylcyclohex-3-en-1-yl]-(1-oxidanidylpyridin-1-ium-2-yl)methanone

Systemtic Name: [(1R,2S,6S)-2,6-diphenylcyclohex-3-en-1-yl]-(1-oxidanidylpyridin-1-ium-2-yl)methanone Openeye Name: [(1R,2S,6S)-2,6-diphenylcyclohex-3-en-1-yl]-(1-oxidopyridin-1-ium-2-yl)methanone CAS Name: [(1R,2S,6S)-2,6-diphenyl-1-cyclohex-3-enyl]-(1-oxido-2-pyridin-1-iumyl)methanone IUPAC Name: [(1R,2S,6S)-2,6-diphenylcyclohex-3-en-1-yl]-(1-oxidopyridin-1-ium-2-yl)methanone Traditional Name: [(1R,2S,6S)-2,6-diphenylcyclohex-3-en-1-yl]-(1-oxidopyridin-1-ium-2-yl)methanone Formula: C24H21NO2 MolecularWeight: 355.42904

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C(C1C2=CC=CC=C2)C(=O)C3=CC=CC=[N+]3[O-])C4=CC=CC=C4

Isomeric SMILES

C1C=C[C@@H]([C@@H]([C@H]1C2=CC=CC=C2)C(=O)C3=CC=CC=[N+]3[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H21NO2/c26-24(22-16-7-8-17-25(22)27)23-20(18-10-3-1-4-11-18)14-9-15-21(23)19-12-5-2-6-13-19/h1-14,16-17,20-21,23H,15H2/t20-,21-,23+/m1/s1