1-cyclopropyl-8-methoxy-7-(5-oxidanyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methoxy-7-(5-oxidanyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(5-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(5-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(5-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(5-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H21NO5S MolecularWeight: 399.46014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5CC(CC5S4)O

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CC5CC(CC5S4)O

InChI

InChI=1S/C21H21NO5S/c1-27-20-13(17-7-10-6-12(23)8-16(10)28-17)4-5-14-18(20)22(11-2-3-11)9-15(19(14)24)21(25)26/h4-5,7,9-12,16,23H,2-3,6,8H2,1H3,(H,25,26)