1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-(2,2,5,5-tetradeuterio-3-methyl-piperazin-1-yl)-3H-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-(2,2,5,5-tetradeuterio-3-methyl-piperazin-1-yl)-3H-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(2,2,5,5-tetradeuterio-3-methyl-piperazin-1-yl)-3H-quinolin-1-ium-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(2,2,5,5-tetradeuterio-3-methyl-1-piperazinyl)-3H-quinolin-1-ium-3-carboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(2,2,5,5-tetradeuterio-3-methylpiperazin-1-yl)-3H-quinolin-1-ium-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-(2,2,5,5-tetradeuterio-3-methyl-piperazino)-3H-quinolin-1-ium-3-carboxylic acid Formula: C19H23FN3O4+ MolecularWeight: 380.42667

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C3C(=O)C(C=[N+](C3=C2OC)C4CC4)C(=O)O)F

Isomeric SMILES

[2H]C1(CN(C(C(N1)C)([2H])[2H])C2=C(C=C3C(=O)C(C=[N+](C3=C2OC)C4CC4)C(=O)O)F)[2H]

InChI

InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,13,21H,3-6,8H2,1-2H3/p+1/i5D2,8D2