4-[[3-[1-(2-chloranyl-6-fluoranyl-3-methyl-phenyl)carbonylpyrrolidin-3-yl]indol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-[1-(2-chloranyl-6-fluoranyl-3-methyl-phenyl)carbonylpyrrolidin-3-yl]indol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[3-[1-(2-chloro-6-fluoro-3-methyl-benzoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile CAS Name: 4-[[3-[1-[(2-chloro-6-fluoro-3-methylphenyl)-oxomethyl]-3-pyrrolidinyl]-1-indolyl]methyl]benzonitrile IUPAC Name: 4-[[3-[1-(2-chloro-6-fluoro-3-methylbenzoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile Traditional Name: 4-[[3-[1-(2-chloro-6-fluoro-3-methyl-benzoyl)pyrrolidin-3-yl]indol-1-yl]methyl]benzonitrile Formula: C28H23ClFN3O MolecularWeight: 471.953123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)F)C(=O)N2CCC(C2)C3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)C#N)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)F)C(=O)N2CCC(C2)C3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)C#N)Cl

InChI

InChI=1S/C28H23ClFN3O/c1-18-6-11-24(30)26(27(18)29)28(34)32-13-12-21(16-32)23-17-33(25-5-3-2-4-22(23)25)15-20-9-7-19(14-31)8-10-20/h2-11,17,21H,12-13,15-16H2,1H3