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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC=CC(=C4)C(F)(F)F)C#N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC=CC(=C4)C(F)(F)F)C#N

InChI

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