[(1R,2S)-2-(4-cyanophenyl)carbonyloxy-1,2-diphenyl-ethyl] 4-cyanobenzoate

Systemtic Name: [(1R,2S)-2-(4-cyanophenyl)carbonyloxy-1,2-diphenyl-ethyl] 4-cyanobenzoate Openeye Name: [(1R,2S)-2-(4-cyanobenzoyl)oxy-1,2-diphenyl-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [(1R,2S)-2-[(4-cyanophenyl)-oxomethoxy]-1,2-diphenylethyl] ester IUPAC Name: [(1R,2S)-2-(4-cyanobenzoyl)oxy-1,2-diphenylethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [(1R,2S)-2-(4-cyanobenzoyl)oxy-1,2-diphenyl-ethyl] ester Formula: C30H20N2O4 MolecularWeight: 472.4908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C#N)OC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)[C@H]([C@H](C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C#N)OC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C30H20N2O4/c31-19-21-11-15-25(16-12-21)29(33)35-27(23-7-3-1-4-8-23)28(24-9-5-2-6-10-24)36-30(34)26-17-13-22(20-32)14-18-26/h1-18,27-28H/t27-,28+