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

Systemtic Name: [(1R,2S)-2-(hydroxymethyl)-2-phenyl-cyclopentyl] 4-nitrobenzoate Openeye Name: [(1R,2S)-2-(hydroxymethyl)-2-phenyl-cyclopentyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,2S)-2-(hydroxymethyl)-2-phenylcyclopentyl] ester IUPAC Name: [(1R,2S)-2-(hydroxymethyl)-2-phenylcyclopentyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,2S)-2-methylol-2-phenyl-cyclopentyl] ester Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO5/c21-13-19(15-5-2-1-3-6-15)12-4-7-17(19)25-18(22)14-8-10-16(11-9-14)20(23)24/h1-3,5-6,8-11,17,21H,4,7,12-13H2/t17-,19-/m1/s1