1-cyclopropyl-7-[6-[ethanoyl(methyl)amino]pyridin-3-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[6-[ethanoyl(methyl)amino]pyridin-3-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[6-[acetyl(methyl)amino]-3-pyridyl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[6-[acetyl(methyl)amino]-3-pyridinyl]-1-cyclopropyl-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[6-[acetyl(methyl)amino]pyridin-3-yl]-1-cyclopropyl-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[6-[acetyl(methyl)amino]-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(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CN=C(C=C4)N(C)C(=O)C

Isomeric SMILES

CC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)C4=CN=C(C=C4)N(C)C(=O)C

InChI

InChI=1S/C22H21N3O4/c1-12-16(14-4-9-19(23-10-14)24(3)13(2)26)7-8-17-20(12)25(15-5-6-15)11-18(21(17)27)22(28)29/h4,7-11,15H,5-6H2,1-3H3,(H,28,29)