6-[(4-fluorophenyl)amino]-7-pyrrolidin-1-yl-isoquinoline-5,8-dione

Systemtic Name: 6-[(4-fluorophenyl)amino]-7-pyrrolidin-1-yl-isoquinoline-5,8-dione Openeye Name: 6-(4-fluoroanilino)-7-pyrrolidin-1-yl-isoquinoline-5,8-dione CAS Name: 6-(4-fluoroanilino)-7-(1-pyrrolidinyl)isoquinoline-5,8-dione IUPAC Name: 6-(4-fluoroanilino)-7-pyrrolidin-1-ylisoquinoline-5,8-dione Traditional Name: 6-(4-fluoroanilino)-7-pyrrolidino-isoquinoline-5,8-quinone Formula: C19H16FN3O2 MolecularWeight: 337.347643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C3=C(C2=O)C=NC=C3)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C3=C(C2=O)C=NC=C3)NC4=CC=C(C=C4)F

InChI

InChI=1S/C19H16FN3O2/c20-12-3-5-13(6-4-12)22-16-17(23-9-1-2-10-23)19(25)15-11-21-8-7-14(15)18(16)24/h3-8,11,22H,1-2,9-10H2