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

Systemtic Name: 1-cyclopropyl-7-[3-(hydroxymethyl)piperidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-(hydroxymethyl)-1-piperidyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-(hydroxymethyl)-1-piperidinyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-(hydroxymethyl)piperidin-1-yl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methyl-7-(3-methylolpiperidino)quinoline-3-carboxylic acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCCC(C4)CO

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CCCC(C4)CO

InChI

InChI=1S/C20H24N2O4/c1-12-17(21-8-2-3-13(9-21)11-23)7-6-15-18(12)22(14-4-5-14)10-16(19(15)24)20(25)26/h6-7,10,13-14,23H,2-5,8-9,11H2,1H3,(H,25,26)