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

Systemtic Name: 6-azanyl-1-cyclopropyl-7-(3,3-dimethylpiperidin-1-yl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-7-(3,3-dimethyl-1-piperidyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-7-(3,3-dimethyl-1-piperidinyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-7-(3,3-dimethylpiperidin-1-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-7-(3,3-dimethylpiperidino)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCCC(C3)(C)C)N)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCCC(C3)(C)C)N)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C21H27N3O3/c1-12-17-14(19(25)15(20(26)27)10-24(17)13-5-6-13)9-16(22)18(12)23-8-4-7-21(2,3)11-23/h9-10,13H,4-8,11,22H2,1-3H3,(H,26,27)