7-azanyl-2-fluoranyl-7-[3-(prop-2-ynylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-dione

Systemtic Name: 7-azanyl-2-fluoranyl-7-[3-(prop-2-ynylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-dione Openeye Name: 7-amino-2-fluoro-7-[3-(prop-2-ynylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-dione CAS Name: 7-amino-2-fluoro-7-[3-(prop-2-ynylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-dione IUPAC Name: 7-amino-2-fluoro-7-[3-(prop-2-ynylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-dione Traditional Name: 7-amino-2-fluoro-7-[3-(propargylamino)phenyl]-5,6-dihydro-4H-isoindole-1,3-quinone Formula: C17H16FN3O2 MolecularWeight: 313.326243

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=CC=CC(=C1)C2(CCCC3=C2C(=O)N(C3=O)F)N

Isomeric SMILES

C#CCNC1=CC=CC(=C1)C2(CCCC3=C2C(=O)N(C3=O)F)N

InChI

InChI=1S/C17H16FN3O2/c1-2-9-20-12-6-3-5-11(10-12)17(19)8-4-7-13-14(17)16(23)21(18)15(13)22/h1,3,5-6,10,20H,4,7-9,19H2