2-(4-methylphenyl)sulfonyl-1,2,5,6-tetrahydrobenzo[e]azulene-3,4-dione

Systemtic Name: 2-(4-methylphenyl)sulfonyl-1,2,5,6-tetrahydrobenzo[e]azulene-3,4-dione Openeye Name: 2-(p-tolylsulfonyl)-1,2,5,6-tetrahydrobenzo[e]azulene-3,4-dione CAS Name: 2-(4-methylphenyl)sulfonyl-1,2,5,6-tetrahydrobenzo[e]azulene-3,4-dione IUPAC Name: 2-(4-methylphenyl)sulfonyl-1,2,5,6-tetrahydrobenzo[e]azulene-3,4-dione Traditional Name: 2-tosyl-1,2,5,6-tetrahydrobenz[e]azulene-3,4-quinone Formula: C21H18O4S MolecularWeight: 366.43022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CC3=C(C2=O)C(=O)CCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2CC3=C(C2=O)C(=O)CCC4=CC=CC=C43

InChI

InChI=1S/C21H18O4S/c1-13-6-9-15(10-7-13)26(24,25)19-12-17-16-5-3-2-4-14(16)8-11-18(22)20(17)21(19)23/h2-7,9-10,19H,8,11-12H2,1H3