2-[3-butan-2-ylsulfonyl-7-chloranyl-2,4-bis(oxidanylidene)quinolin-1-yl]ethanoic acid

Systemtic Name: 2-[3-butan-2-ylsulfonyl-7-chloranyl-2,4-bis(oxidanylidene)quinolin-1-yl]ethanoic acid Openeye Name: 2-(7-chloro-2,4-dioxo-3-sec-butylsulfonyl-1-quinolyl)acetic acid CAS Name: 2-(3-butan-2-ylsulfonyl-7-chloro-2,4-dioxo-1-quinolinyl)acetic acid IUPAC Name: 2-(3-butan-2-ylsulfonyl-7-chloro-2,4-dioxoquinolin-1-yl)acetic acid Traditional Name: 2-(7-chloro-2,4-diketo-3-sec-butylsulfonyl-1-quinolyl)acetic acid Formula: C15H16ClNO6S MolecularWeight: 373.80864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)S(=O)(=O)C1C(=O)C2=C(C=C(C=C2)Cl)N(C1=O)CC(=O)O

Isomeric SMILES

CCC(C)S(=O)(=O)C1C(=O)C2=C(C=C(C=C2)Cl)N(C1=O)CC(=O)O

InChI

InChI=1S/C15H16ClNO6S/c1-3-8(2)24(22,23)14-13(20)10-5-4-9(16)6-11(10)17(15(14)21)7-12(18)19/h4-6,8,14H,3,7H2,1-2H3,(H,18,19)