3-[[3,4-bis(oxidanylidene)-2-phenyl-cyclobuten-1-yl]sulfanylmethyl]-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[3,4-bis(oxidanylidene)-2-phenyl-cyclobuten-1-yl]sulfanylmethyl]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[(3,4-dioxo-2-phenyl-cyclobuten-1-yl)sulfanylmethyl]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[[(3,4-dioxo-2-phenyl-1-cyclobutenyl)thio]methyl]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[(3,4-dioxo-2-phenylcyclobuten-1-yl)sulfanylmethyl]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[(3,4-diketo-2-phenyl-cyclobuten-1-yl)thio]methyl]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C21H12O4S MolecularWeight: 360.38258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C2=O)CSC3=C(C(=O)C3=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C2=O)CSC3=C(C(=O)C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H12O4S/c22-17-14(15(18(17)23)12-7-3-1-4-8-12)11-26-21-16(19(24)20(21)25)13-9-5-2-6-10-13/h1-10H,11H2