2-(4-methylsulfonylphenyl)benzo[h]quinoline-4-carboxylic acid

Systemtic Name: 2-(4-methylsulfonylphenyl)benzo[h]quinoline-4-carboxylic acid Openeye Name: 2-(4-methylsulfonylphenyl)benzo[h]quinoline-4-carboxylic acid CAS Name: 2-(4-methylsulfonylphenyl)-4-benzo[h]quinolinecarboxylic acid IUPAC Name: 2-(4-methylsulfonylphenyl)benzo[h]quinoline-4-carboxylic acid Traditional Name: 2-(4-mesylphenyl)benzo[h]quinoline-4-carboxylic acid Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(C=CC4=CC=CC=C43)C(=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(C=CC4=CC=CC=C43)C(=C2)C(=O)O

InChI

InChI=1S/C21H15NO4S/c1-27(25,26)15-9-6-14(7-10-15)19-12-18(21(23)24)17-11-8-13-4-2-3-5-16(13)20(17)22-19/h2-12H,1H3,(H,23,24)