5-azanyl-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)C2=CC(=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)N

Isomeric SMILES

CC1=CC(=CC(=N1)C)C2=CC(=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)N

InChI

InChI=1S/C21H21N3O3/c1-10-6-13(7-11(2)23-10)15-8-17(22)18-19(12(15)3)24(14-4-5-14)9-16(20(18)25)21(26)27/h6-9,14H,4-5,22H2,1-3H3,(H,26,27)