[(2S,4S,6R)-2-phenyl-6-[(E)-2-phenylethenyl]oxan-4-yl] 4-nitrobenzoate

Systemtic Name: [(2S,4S,6R)-2-phenyl-6-[(E)-2-phenylethenyl]oxan-4-yl] 4-nitrobenzoate Openeye Name: [(2S,4S,6R)-2-phenyl-6-[(E)-styryl]tetrahydropyran-4-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,4S,6R)-2-phenyl-6-[(E)-2-phenylethenyl]-4-oxanyl] ester IUPAC Name: [(2S,4S,6R)-2-phenyl-6-[(E)-2-phenylethenyl]oxan-4-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S,4S,6R)-2-phenyl-6-[(E)-styryl]tetrahydropyran-4-yl] ester Formula: C26H23NO5 MolecularWeight: 429.46452

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(OC1C=CC2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](C[C@H](O[C@H]1/C=C/C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H23NO5/c28-26(21-12-14-22(15-13-21)27(29)30)32-24-17-23(16-11-19-7-3-1-4-8-19)31-25(18-24)20-9-5-2-6-10-20/h1-16,23-25H,17-18H2/b16-11+/t23-,24-,25-/m0/s1