7-(6-acetamido-5-methyl-pyridin-3-yl)-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(6-acetamido-5-methyl-pyridin-3-yl)-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(6-acetamido-5-methyl-3-pyridyl)-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(6-acetamido-5-methyl-3-pyridinyl)-1-cyclopropyl-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(6-acetamido-5-methylpyridin-3-yl)-1-cyclopropyl-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(6-acetamido-5-methyl-3-pyridyl)-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C22H21N3O4 MolecularWeight: 391.41984

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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)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4/c1-11-8-14(9-23-21(11)24-13(3)26)16-6-7-17-19(12(16)2)25(15-4-5-15)10-18(20(17)27)22(28)29/h6-10,15H,4-5H2,1-3H3,(H,28,29)(H,23,24,26)