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

Systemtic Name: 6-azanyl-1-cyclopropyl-7-(3,5-dimethylpiperidin-1-yl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-7-(3,5-dimethyl-1-piperidyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-7-(3,5-dimethyl-1-piperidinyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-7-(3,5-dimethylpiperidin-1-yl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-7-(3,5-dimethylpiperidino)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)N)C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C3C(=C2C)N(C=C(C3=O)C(=O)O)C4CC4)N)C

InChI

InChI=1S/C21H27N3O3/c1-11-6-12(2)9-23(8-11)19-13(3)18-15(7-17(19)22)20(25)16(21(26)27)10-24(18)14-4-5-14/h7,10-12,14H,4-6,8-9,22H2,1-3H3,(H,26,27)