1-cyclopropyl-7-[4-(hydroxymethyl)-3-oxidanyl-piperidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(hydroxymethyl)-3-oxidanyl-piperidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-hydroxy-4-(hydroxymethyl)-1-piperidyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-hydroxy-4-(hydroxymethyl)-1-piperidinyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-hydroxy-4-(hydroxymethyl)piperidin-1-yl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(3-hydroxy-4-methylol-piperidino)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCC(C(C4)O)CO

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCC(C(C4)O)CO

InChI

InChI=1S/C20H24N2O5/c1-11-16(21-7-6-12(10-23)17(24)9-21)5-4-14-18(11)22(13-2-3-13)8-15(19(14)25)20(26)27/h4-5,8,12-13,17,23-24H,2-3,6-7,9-10H2,1H3,(H,26,27)