2-(1-benzothiophen-3-yl)-3,6-bis(oxidanyl)-5-quinolin-8-yl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(1-benzothiophen-3-yl)-3,6-bis(oxidanyl)-5-quinolin-8-yl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(benzothiophen-3-yl)-3,6-dihydroxy-5-(8-quinolyl)-1,4-benzoquinone CAS Name: 2-(1-benzothiophen-3-yl)-3,6-dihydroxy-5-(8-quinolinyl)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(1-benzothiophen-3-yl)-3,6-dihydroxy-5-quinolin-8-ylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(benzothiophen-3-yl)-3,6-dihydroxy-5-(8-quinolyl)-p-benzoquinone Formula: C23H13NO4S MolecularWeight: 399.41862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C3=C(C(=O)C(=C(C3=O)O)C4=CC=CC5=C4N=CC=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C3=C(C(=O)C(=C(C3=O)O)C4=CC=CC5=C4N=CC=C5)O

InChI

InChI=1S/C23H13NO4S/c25-20-17(14-8-3-5-12-6-4-10-24-19(12)14)21(26)23(28)18(22(20)27)15-11-29-16-9-2-1-7-13(15)16/h1-11,25,28H