2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbonitrile

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbonitrile Openeye Name: 2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbonitrile CAS Name: 2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-[3-(trifluoromethyl)phenyl]-3-pyrrolecarbonitrile IUPAC Name: 2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbonitrile Traditional Name: 2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbonitrile Formula: C24H21F3N4O2 MolecularWeight: 454.44435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC=CC(=C4)C(F)(F)F)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC=CC(=C4)C(F)(F)F)C#N

InChI

InChI=1S/C24H21F3N4O2/c1-33-21-7-5-19(6-8-21)29-11-13-30(14-12-29)23(32)22-17(16-28)9-10-31(22)20-4-2-3-18(15-20)24(25,26)27/h2-10,15H,11-14H2,1H3