[(1R,2R)-2-phenylcyclopentyl] 4-nitrobenzoate

Systemtic Name: [(1R,2R)-2-phenylcyclopentyl] 4-nitrobenzoate Openeye Name: [(1R,2R)-2-phenylcyclopentyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,2R)-2-phenylcyclopentyl] ester IUPAC Name: [(1R,2R)-2-phenylcyclopentyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,2R)-2-phenylcyclopentyl] ester Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]([C@@H](C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H17NO4/c20-18(14-9-11-15(12-10-14)19(21)22)23-17-8-4-7-16(17)13-5-2-1-3-6-13/h1-3,5-6,9-12,16-17H,4,7-8H2/t16-,17-/m1/s1