1-cyclopropyl-8-methyl-7-[5-methyl-6-(2-oxidanylidenepropylamino)pyridin-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-(2-oxidanylidenepropylamino)pyridin-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[6-(acetonylamino)-5-methyl-3-pyridyl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-(2-oxopropylamino)-3-pyridinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-(2-oxopropylamino)pyridin-3-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[6-(acetonylamino)-5-methyl-3-pyridyl]-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)NCC(=O)C

Isomeric SMILES

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)NCC(=O)C

InChI

InChI=1S/C23H23N3O4/c1-12-8-15(10-25-22(12)24-9-13(2)27)17-6-7-18-20(14(17)3)26(16-4-5-16)11-19(21(18)28)23(29)30/h6-8,10-11,16H,4-5,9H2,1-3H3,(H,24,25)(H,29,30)