(3aR,4S)-4-(phenylsulfonyl)-2,3,3a,4-tetrahydropentalene-1,5-dione

Systemtic Name: (3aR,4S)-4-(phenylsulfonyl)-2,3,3a,4-tetrahydropentalene-1,5-dione Openeye Name: (3aR,4S)-4-(benzenesulfonyl)-2,3,3a,4-tetrahydropentalene-1,5-dione CAS Name: (3aR,4S)-4-(benzenesulfonyl)-2,3,3a,4-tetrahydropentalene-1,5-dione IUPAC Name: (3aR,4S)-4-(benzenesulfonyl)-2,3,3a,4-tetrahydropentalene-1,5-dione Traditional Name: (3aR,4S)-4-besyl-2,3,3a,4-tetrahydropentalene-1,5-quinone Formula: C14H12O4S MolecularWeight: 276.30768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=CC(=O)C(C21)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(=O)C2=CC(=O)[C@H]([C@@H]21)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H12O4S/c15-12-7-6-10-11(12)8-13(16)14(10)19(17,18)9-4-2-1-3-5-9/h1-5,8,10,14H,6-7H2/t10-,14+/m1/s1