8-(3,4-dimethylpiperazin-1-yl)-7-fluoranyl-1-methyl-4-oxidanylidene-benzo[b][1,8]naphthyridine-3-carboxylic acid

Systemtic Name: 8-(3,4-dimethylpiperazin-1-yl)-7-fluoranyl-1-methyl-4-oxidanylidene-benzo[b][1,8]naphthyridine-3-carboxylic acid Openeye Name: 8-(3,4-dimethylpiperazin-1-yl)-7-fluoro-1-methyl-4-oxo-benzo[b][1,8]naphthyridine-3-carboxylic acid CAS Name: 8-(3,4-dimethyl-1-piperazinyl)-7-fluoro-1-methyl-4-oxo-3-benzo[b][1,8]naphthyridinecarboxylic acid IUPAC Name: 8-(3,4-dimethylpiperazin-1-yl)-7-fluoro-1-methyl-4-oxobenzo[b][1,8]naphthyridine-3-carboxylic acid Traditional Name: 8-(3,4-dimethylpiperazino)-7-fluoro-4-keto-1-methyl-benzo[b][1,8]naphthyridine-3-carboxylic acid Formula: C20H21FN4O3 MolecularWeight: 384.404143

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C)C2=CC3=NC4=C(C=C3C=C2F)C(=O)C(=CN4C)C(=O)O

Isomeric SMILES

CC1CN(CCN1C)C2=CC3=NC4=C(C=C3C=C2F)C(=O)C(=CN4C)C(=O)O

InChI

InChI=1S/C20H21FN4O3/c1-11-9-25(5-4-23(11)2)17-8-16-12(7-15(17)21)6-13-18(26)14(20(27)28)10-24(3)19(13)22-16/h6-8,10-11H,4-5,9H2,1-3H3,(H,27,28)