(2'S,4S)-2,2'-diphenylspiro[1,3-oxazole-4,3'-bicyclo[2.2.1]hept-5-ene]-5-one

Systemtic Name: (2'S,4S)-2,2'-diphenylspiro[1,3-oxazole-4,3'-bicyclo[2.2.1]hept-5-ene]-5-one Openeye Name: (2S,3S)-2,2'-diphenylspiro[bicyclo[2.2.1]hept-5-ene-3,4'-oxazole]-5'-one CAS Name: (2S,3S)-2,2'-diphenyl-5'-spiro[bicyclo[2.2.1]hept-5-ene-3,4'-oxazole]one IUPAC Name: (2'S,4S)-2,2'-diphenylspiro[1,3-oxazole-4,3'-bicyclo[2.2.1]hept-5-ene]-5-one Traditional Name: (2'S,4S)-2,2'-diphenylspiro[2-oxazoline-4,3'-bicyclo[2.2.1]hept-5-ene]-5-one Formula: C21H17NO2 MolecularWeight: 315.36518

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1C3(C2C4=CC=CC=C4)C(=O)OC(=N3)C5=CC=CC=C5

Isomeric SMILES

C1C2C=CC1[C@]3([C@@H]2C4=CC=CC=C4)C(=O)OC(=N3)C5=CC=CC=C5

InChI

InChI=1S/C21H17NO2/c23-20-21(22-19(24-20)15-9-5-2-6-10-15)17-12-11-16(13-17)18(21)14-7-3-1-4-8-14/h1-12,16-18H,13H2/t16?,17?,18-,21+/m1/s1