9-butyl-4-oxidanylidene-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid

Systemtic Name: 9-butyl-4-oxidanylidene-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid Openeye Name: 9-butyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid CAS Name: 9-butyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid IUPAC Name: 9-butyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid Traditional Name: 9-butyl-4-keto-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)SCC3=C2NC(=CC3=O)C(=O)O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)SCC3=C2NC(=CC3=O)C(=O)O

InChI

InChI=1S/C17H17NO3S/c1-2-3-4-10-5-6-15-11(7-10)16-12(9-22-15)14(19)8-13(18-16)17(20)21/h5-8H,2-4,9H2,1H3,(H,18,19)(H,20,21)