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

Systemtic Name: 5-(7-fluoranyl-3,3-dimethyl-2-oxidanylidene-1-phenethyl-indol-5-yl)-1-methyl-pyrrole-2-carbonitrile Openeye Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-phenethyl-indolin-5-yl)-1-methyl-pyrrole-2-carbonitrile CAS Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-phenethyl-5-indolyl)-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 5-(7-fluoro-3,3-dimethyl-2-oxo-1-phenethylindol-5-yl)-1-methylpyrrole-2-carbonitrile Traditional Name: 5-(7-fluoro-2-keto-3,3-dimethyl-1-phenethyl-indolin-5-yl)-1-methyl-pyrrole-2-carbonitrile Formula: C24H22FN3O MolecularWeight: 387.449383

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)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C2=C(C(=CC(=C2)C3=CC=C(N3C)C#N)F)N(C1=O)CCC4=CC=CC=C4)C

InChI

InChI=1S/C24H22FN3O/c1-24(2)19-13-17(21-10-9-18(15-26)27(21)3)14-20(25)22(19)28(23(24)29)12-11-16-7-5-4-6-8-16/h4-10,13-14H,11-12H2,1-3H3