1-cyclopropyl-8-methoxy-4-oxidanylidene-7-(7-oxidanylidene-5,6-dihydro-4H-1-benzothiophen-2-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methoxy-4-oxidanylidene-7-(7-oxidanylidene-5,6-dihydro-4H-1-benzothiophen-2-yl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methoxy-4-oxo-7-(7-oxo-5,6-dihydro-4H-benzothiophen-2-yl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methoxy-4-oxo-7-(7-oxo-5,6-dihydro-4H-1-benzothiophen-2-yl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methoxy-4-oxo-7-(7-oxo-5,6-dihydro-4H-1-benzothiophen-2-yl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-7-(7-keto-5,6-dihydro-4H-benzothiophen-2-yl)-8-methoxy-quinoline-3-carboxylic acid Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)C(=O)CCC5

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5=C(S4)C(=O)CCC5

InChI

InChI=1S/C22H19NO5S/c1-28-20-13(17-9-11-3-2-4-16(24)21(11)29-17)7-8-14-18(20)23(12-5-6-12)10-15(19(14)25)22(26)27/h7-10,12H,2-6H2,1H3,(H,26,27)