5-(7-fluoranyl-3,3-dimethyl-2-oxidanylidene-1-prop-2-ynyl-indol-5-yl)-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 5-(7-fluoranyl-3,3-dimethyl-2-oxidanylidene-1-prop-2-ynyl-indol-5-yl)-1-methyl-pyrrole-2-carbonitrile Openeye Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-prop-2-ynyl-indolin-5-yl)-1-methyl-pyrrole-2-carbonitrile CAS Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-prop-2-ynyl-5-indolyl)-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-prop-2-ynylindol-5-yl)-1-methylpyrrole-2-carbonitrile Traditional Name: 5-(7-fluoro-2-keto-3,3-dimethyl-1-propargyl-indolin-5-yl)-1-methyl-pyrrole-2-carbonitrile Formula: C19H16FN3O MolecularWeight: 321.348243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=CC(=C2)C3=CC=C(N3C)C#N)F)N(C1=O)CC#C)C

Isomeric SMILES

CC1(C2=C(C(=CC(=C2)C3=CC=C(N3C)C#N)F)N(C1=O)CC#C)C

InChI

InChI=1S/C19H16FN3O/c1-5-8-23-17-14(19(2,3)18(23)24)9-12(10-15(17)20)16-7-6-13(11-21)22(16)4/h1,6-7,9-10H,8H2,2-4H3