1-[7-fluoranyl-3-oxidanylidene-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethyl-pyrrole-2,5-dione

Systemtic Name: 1-[7-fluoranyl-3-oxidanylidene-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethyl-pyrrole-2,5-dione Openeye Name: 1-[7-fluoro-3-oxo-4-(2-pyridylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethyl-pyrrole-2,5-dione CAS Name: 1-[7-fluoro-3-oxo-4-(2-pyridinylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethylpyrrole-2,5-dione IUPAC Name: 1-[7-fluoro-3-oxo-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethylpyrrole-2,5-dione Traditional Name: 1-[7-fluoro-3-keto-4-(2-pyridylmethyl)-1,4-benzoxazin-6-yl]-3,4-dimethyl-3-pyrroline-2,5-quinone Formula: C20H16FN3O4 MolecularWeight: 381.357143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1=O)C2=C(C=C3C(=C2)N(C(=O)CO3)CC4=CC=CC=N4)F)C

Isomeric SMILES

CC1=C(C(=O)N(C1=O)C2=C(C=C3C(=C2)N(C(=O)CO3)CC4=CC=CC=N4)F)C

InChI

InChI=1S/C20H16FN3O4/c1-11-12(2)20(27)24(19(11)26)15-8-16-17(7-14(15)21)28-10-18(25)23(16)9-13-5-3-4-6-22-13/h3-8H,9-10H2,1-2H3