4-[3-fluoranyl-4-[[5-oxidanylidene-1-(3-phenylpropyl)-4-prop-2-enyl-pyrrolidin-2-yl]methoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[3-fluoranyl-4-[[5-oxidanylidene-1-(3-phenylpropyl)-4-prop-2-enyl-pyrrolidin-2-yl]methoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[[4-allyl-5-oxo-1-(3-phenylpropyl)pyrrolidin-2-yl]methoxy]-3-fluoro-phenyl]benzonitrile CAS Name: 4-[3-fluoro-4-[[5-oxo-1-(3-phenylpropyl)-4-prop-2-enyl-2-pyrrolidinyl]methoxy]phenyl]benzonitrile IUPAC Name: 4-[3-fluoro-4-[[5-oxo-1-(3-phenylpropyl)-4-prop-2-enylpyrrolidin-2-yl]methoxy]phenyl]benzonitrile Traditional Name: 4-[4-[[4-allyl-5-keto-1-(3-phenylpropyl)pyrrolidin-2-yl]methoxy]-3-fluoro-phenyl]benzonitrile Formula: C30H29FN2O2 MolecularWeight: 468.561863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1CC(N(C1=O)CCCC2=CC=CC=C2)COC3=C(C=C(C=C3)C4=CC=C(C=C4)C#N)F

Isomeric SMILES

C=CCC1CC(N(C1=O)CCCC2=CC=CC=C2)COC3=C(C=C(C=C3)C4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C30H29FN2O2/c1-2-7-26-18-27(33(30(26)34)17-6-10-22-8-4-3-5-9-22)21-35-29-16-15-25(19-28(29)31)24-13-11-23(20-32)12-14-24/h2-5,8-9,11-16,19,26-27H,1,6-7,10,17-18,21H2