5,7-bis(bromanyl)-9-(4-hexylphenyl)carbonyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid

Systemtic Name: 5,7-bis(bromanyl)-9-(4-hexylphenyl)carbonyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Openeye Name: 5,7-dibromo-9-(4-hexylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid CAS Name: 5,7-dibromo-9-[(4-hexylphenyl)-oxomethyl]-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid IUPAC Name: 5,7-dibromo-9-(4-hexylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Traditional Name: 5,7-dibromo-9-(4-hexylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Formula: C27H27Br2NO5 MolecularWeight: 605.31498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=C(C=C(C=C42)Br)Br

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=C(C=C(C=C42)Br)Br

InChI

InChI=1S/C27H27Br2NO5/c1-2-3-4-5-6-16-7-9-17(10-8-16)24(31)30-21-11-12-27(25(32)33,26(34)35)15-19(21)23-20(29)13-18(28)14-22(23)30/h7-10,13-14H,2-6,11-12,15H2,1H3,(H,32,33)(H,34,35)