4-(4-hydroxyphenyl)-4-methyl-10-oxidanylidene-9-(phenylmethyl)thieno[2,3-b]carbazole-2-carboxylic acid

Systemtic Name: 4-(4-hydroxyphenyl)-4-methyl-10-oxidanylidene-9-(phenylmethyl)thieno[2,3-b]carbazole-2-carboxylic acid Openeye Name: 9-benzyl-4-(4-hydroxyphenyl)-4-methyl-10-oxo-thieno[2,3-b]carbazole-2-carboxylic acid CAS Name: 4-(4-hydroxyphenyl)-4-methyl-10-oxo-9-(phenylmethyl)-2-thieno[2,3-b]carbazolecarboxylic acid IUPAC Name: 9-benzyl-4-(4-hydroxyphenyl)-4-methyl-10-oxothieno[2,3-b]carbazole-2-carboxylic acid Traditional Name: 9-benzyl-4-(4-hydroxyphenyl)-10-keto-4-methyl-thieno[2,3-b]carbazole-2-carboxylic acid Formula: C29H21NO4S MolecularWeight: 479.54634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=O)C3=C1C4=CC=CC=C4N3CC5=CC=CC=C5)SC(=C2)C(=O)O)C6=CC=C(C=C6)O

Isomeric SMILES

CC1(C2=C(C(=O)C3=C1C4=CC=CC=C4N3CC5=CC=CC=C5)SC(=C2)C(=O)O)C6=CC=C(C=C6)O

InChI

InChI=1S/C29H21NO4S/c1-29(18-11-13-19(31)14-12-18)21-15-23(28(33)34)35-27(21)26(32)25-24(29)20-9-5-6-10-22(20)30(25)16-17-7-3-2-4-8-17/h2-15,31H,16H2,1H3,(H,33,34)