1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-[3-(ethylaminomethyl)-1-pyrrolidinyl]-6,8-difluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidino]-6,8-difluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C20H25F2N3O3 MolecularWeight: 393.427606

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1CCN(C1)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)C)F

Isomeric SMILES

CCNCC1CCN(C1)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)C)F

InChI

InChI=1S/C20H25F2N3O3/c1-4-23-8-12-6-7-25(9-12)18-15(21)11(3)14-17(16(18)22)24(5-2)10-13(19(14)26)20(27)28/h10,12,23H,4-9H2,1-3H3,(H,27,28)