[3-ethenyl-3-(phenylsulfonyl)cyclobutyl] 4-nitrobenzoate

Systemtic Name: [3-ethenyl-3-(phenylsulfonyl)cyclobutyl] 4-nitrobenzoate Openeye Name: [3-(benzenesulfonyl)-3-vinyl-cyclobutyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-(benzenesulfonyl)-3-ethenylcyclobutyl] ester IUPAC Name: [3-(benzenesulfonyl)-3-ethenylcyclobutyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (3-besyl-3-vinyl-cyclobutyl) ester Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1(CC(C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C=CC1(CC(C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17NO6S/c1-2-19(27(24,25)17-6-4-3-5-7-17)12-16(13-19)26-18(21)14-8-10-15(11-9-14)20(22)23/h2-11,16H,1,12-13H2