2-azanyl-2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-3-(3-methoxy-1,2-oxazol-5-yl)-1-phenyl-propan-1-one hydrobromide

Systemtic Name: 2-azanyl-2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-3-(3-methoxy-1,2-oxazol-5-yl)-1-phenyl-propan-1-one hydrobromide Openeye Name: 2-amino-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-3-(3-methoxyisoxazol-5-yl)-1-phenyl-propan-1-one hydrobromide CAS Name: 2-amino-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-3-(3-methoxy-5-isoxazolyl)-1-phenyl-1-propanone hydrobromide IUPAC Name: 2-amino-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-3-(3-methoxy-1,2-oxazol-5-yl)-1-phenylpropan-1-one hydrobromide Traditional Name: 2-amino-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-3-(3-methoxyisoxazol-5-yl)-1-phenyl-propan-1-one hydrobromide Formula: C25H28BrFN4O5 MolecularWeight: 563.416023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C2C(=C1)CN(C2=N)C(CC3=CC(=NO3)OC)(C(=O)C4=CC=CC=C4)N)F)OCC.Br

Isomeric SMILES

CCOC1=C(C(=C2C(=C1)CN(C2=N)C(CC3=CC(=NO3)OC)(C(=O)C4=CC=CC=C4)N)F)OCC.Br

InChI

InChI=1S/C25H27FN4O5.BrH/c1-4-33-18-11-16-14-30(24(27)20(16)21(26)22(18)34-5-2)25(28,13-17-12-19(32-3)29-35-17)23(31)15-9-7-6-8-10-15;/h6-12,27H,4-5,13-14,28H2,1-3H3;1H