(1S,2R,3S,6R)-2-ethoxycarbonyl-3,6-diphenyl-cyclohexane-1-carboxylate

Systemtic Name: (1S,2R,3S,6R)-2-ethoxycarbonyl-3,6-diphenyl-cyclohexane-1-carboxylate Openeye Name: (1S,2R,3S,6R)-2-ethoxycarbonyl-3,6-diphenyl-cyclohexanecarboxylate CAS Name: (1S,2R,3S,6R)-2-ethoxycarbonyl-3,6-diphenyl-1-cyclohexanecarboxylate IUPAC Name: (1S,2R,3S,6R)-2-ethoxycarbonyl-3,6-diphenylcyclohexane-1-carboxylate Traditional Name: (1S,2R,3S,6R)-2-carbethoxy-3,6-diphenyl-cyclohexanecarboxylate Formula: C22H23O4- MolecularWeight: 351.41562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CCC(C1C(=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](CC[C@H]([C@@H]1C(=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24O4/c1-2-26-22(25)20-18(16-11-7-4-8-12-16)14-13-17(19(20)21(23)24)15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3,(H,23,24)/p-1/t17-,18+,19-,20+/m0/s1