4,9-dimethyl-10-oxidanylidene-4-[3-(4-oxidanyl-4-oxidanylidene-butyl)phenyl]thieno[2,3-b]carbazole-2-carboxylic acid

Systemtic Name: 4,9-dimethyl-10-oxidanylidene-4-[3-(4-oxidanyl-4-oxidanylidene-butyl)phenyl]thieno[2,3-b]carbazole-2-carboxylic acid Openeye Name: 4-[3-(4-hydroxy-4-oxo-butyl)phenyl]-4,9-dimethyl-10-oxo-thieno[2,3-b]carbazole-2-carboxylic acid CAS Name: 4-[3-(4-hydroxy-4-oxobutyl)phenyl]-4,9-dimethyl-10-oxo-2-thieno[2,3-b]carbazolecarboxylic acid IUPAC Name: 4-[3-(4-hydroxy-4-oxobutyl)phenyl]-4,9-dimethyl-10-oxothieno[2,3-b]carbazole-2-carboxylic acid Traditional Name: 4-[3-(4-hydroxy-4-keto-butyl)phenyl]-10-keto-4,9-dimethyl-thieno[2,3-b]carbazole-2-carboxylic acid Formula: C27H23NO5S MolecularWeight: 473.54022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=O)C3=C1C4=CC=CC=C4N3C)SC(=C2)C(=O)O)C5=CC(=CC=C5)CCCC(=O)O

Isomeric SMILES

CC1(C2=C(C(=O)C3=C1C4=CC=CC=C4N3C)SC(=C2)C(=O)O)C5=CC(=CC=C5)CCCC(=O)O

InChI

InChI=1S/C27H23NO5S/c1-27(16-9-5-7-15(13-16)8-6-12-21(29)30)18-14-20(26(32)33)34-25(18)24(31)23-22(27)17-10-3-4-11-19(17)28(23)2/h3-5,7,9-11,13-14H,6,8,12H2,1-2H3,(H,29,30)(H,32,33)