[(1S)-5-propan-2-yl-2-bicyclo[3.1.0]hex-2-enyl] 4-nitrobenzoate

Systemtic Name: [(1S)-5-propan-2-yl-2-bicyclo[3.1.0]hex-2-enyl] 4-nitrobenzoate Openeye Name: [(1S)-5-isopropyl-2-bicyclo[3.1.0]hex-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1S)-5-propan-2-yl-2-bicyclo[3.1.0]hex-2-enyl] ester IUPAC Name: [(1S)-5-propan-2-yl-2-bicyclo[3.1.0]hex-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S)-5-isopropyl-2-bicyclo[3.1.0]hex-2-enyl] ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C12CC=C(C1C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@]12CC=C([C@H]1C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17NO4/c1-10(2)16-8-7-14(13(16)9-16)21-15(18)11-3-5-12(6-4-11)17(19)20/h3-7,10,13H,8-9H2,1-2H3/t13-,16-/m1/s1