8-[(2R,3S)-3-azanyl-2-methyl-azetidin-1-yl]-7-fluoranyl-1-methyl-4-oxidanylidene-1H-benzo[c]cinnoline-3-carboxylic acid

Systemtic Name: 8-[(2R,3S)-3-azanyl-2-methyl-azetidin-1-yl]-7-fluoranyl-1-methyl-4-oxidanylidene-1H-benzo[c]cinnoline-3-carboxylic acid Openeye Name: 8-[(2R,3S)-3-amino-2-methyl-azetidin-1-yl]-7-fluoro-1-methyl-4-oxo-1H-benzo[c]cinnoline-3-carboxylic acid CAS Name: 8-[(2R,3S)-3-amino-2-methyl-1-azetidinyl]-7-fluoro-1-methyl-4-oxo-1H-benzo[c]cinnoline-3-carboxylic acid IUPAC Name: 8-[(2R,3S)-3-amino-2-methylazetidin-1-yl]-7-fluoro-1-methyl-4-oxo-1H-benzo[c]cinnoline-3-carboxylic acid Traditional Name: 8-[(2R,3S)-3-amino-2-methyl-azetidin-1-yl]-7-fluoro-4-keto-1-methyl-1H-benzo[c]cinnoline-3-carboxylic acid Formula: C18H17FN4O3 MolecularWeight: 356.350983

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(=O)C2=NN=C3C(=C12)C=CC(=C3F)N4CC(C4C)N)C(=O)O

Isomeric SMILES

C[C@@H]1[C@H](CN1C2=C(C3=NN=C4C(=C3C=C2)C(C=C(C4=O)C(=O)O)C)F)N

InChI

InChI=1S/C18H17FN4O3/c1-7-5-10(18(25)26)17(24)16-13(7)9-3-4-12(14(19)15(9)21-22-16)23-6-11(20)8(23)2/h3-5,7-8,11H,6,20H2,1-2H3,(H,25,26)/t7?,8-,11+/m1/s1