methyl 4-[(2R,6S)-6-(4-methoxycarbonylphenyl)-4-phenyl-oxan-2-yl]benzoate

Systemtic Name: methyl 4-[(2R,6S)-6-(4-methoxycarbonylphenyl)-4-phenyl-oxan-2-yl]benzoate Openeye Name: methyl 4-[(2R,6S)-6-(4-methoxycarbonylphenyl)-4-phenyl-tetrahydropyran-2-yl]benzoate CAS Name: 4-[(2R,6S)-6-(4-methoxycarbonylphenyl)-4-phenyl-2-oxanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2R,6S)-6-(4-methoxycarbonylphenyl)-4-phenyloxan-2-yl]benzoate Traditional Name: 4-[(2R,6S)-6-(4-carbomethoxyphenyl)-4-phenyl-tetrahydropyran-2-yl]benzoic acid methyl ester Formula: C27H26O5 MolecularWeight: 430.49234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2CC(CC(O2)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)[C@H]2CC(C[C@H](O2)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H26O5/c1-30-26(28)21-12-8-19(9-13-21)24-16-23(18-6-4-3-5-7-18)17-25(32-24)20-10-14-22(15-11-20)27(29)31-2/h3-15,23-25H,16-17H2,1-2H3/t23?,24-,25+