5-(1-fluoroethyl)-2-(4-methyl-5-oxidanylidene-imidazol-2-yl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid

Systemtic Name: 5-(1-fluoroethyl)-2-(4-methyl-5-oxidanylidene-imidazol-2-yl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Openeye Name: 5-(1-fluoroethyl)-2-(4-methyl-5-oxo-imidazol-2-yl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid CAS Name: 5-(1-fluoroethyl)-2-(4-methyl-5-oxo-2-imidazolyl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid IUPAC Name: 5-(1-fluoroethyl)-2-(4-methyl-5-oxoimidazol-2-yl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Traditional Name: 5-(1-fluoroethyl)-2-(4-keto-5-methyl-imidazol-2-yl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Formula: C16H16FN3O3 MolecularWeight: 317.314943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC1=O)C2=NC3=C(C=C2C(=O)O)C(CCC3)C(C)F

Isomeric SMILES

CC1=NC(=NC1=O)C2=NC3=C(C=C2C(=O)O)C(CCC3)C(C)F

InChI

InChI=1S/C16H16FN3O3/c1-7(17)9-4-3-5-12-10(9)6-11(16(22)23)13(19-12)14-18-8(2)15(21)20-14/h6-7,9H,3-5H2,1-2H3,(H,22,23)