[(1R,2S)-2-ethanoyl-2-phenyl-cyclopentyl] 4-nitrobenzoate

Systemtic Name: [(1R,2S)-2-ethanoyl-2-phenyl-cyclopentyl] 4-nitrobenzoate Openeye Name: [(1R,2S)-2-acetyl-2-phenyl-cyclopentyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,2S)-2-acetyl-2-phenylcyclopentyl] ester IUPAC Name: [(1R,2S)-2-acetyl-2-phenylcyclopentyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,2S)-2-acetyl-2-phenyl-cyclopentyl] ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCCC1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO5/c1-14(22)20(16-6-3-2-4-7-16)13-5-8-18(20)26-19(23)15-9-11-17(12-10-15)21(24)25/h2-4,6-7,9-12,18H,5,8,13H2,1H3/t18-,20+/m1/s1