5-(4-bromophenyl)-1-propan-2-yl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile

Systemtic Name: 5-(4-bromophenyl)-1-propan-2-yl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile Openeye Name: 5-(4-bromophenyl)-1-isopropyl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile CAS Name: 5-(4-bromophenyl)-1-propan-2-yl-3,4-bis(trifluoromethyl)-2-pyrrolecarbonitrile IUPAC Name: 5-(4-bromophenyl)-1-propan-2-yl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile Traditional Name: 5-(4-bromophenyl)-1-isopropyl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile Formula: C16H11BrF6N2 MolecularWeight: 425.166359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C(=C1C2=CC=C(C=C2)Br)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC(C)N1C(=C(C(=C1C2=CC=C(C=C2)Br)C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C16H11BrF6N2/c1-8(2)25-11(7-24)12(15(18,19)20)13(16(21,22)23)14(25)9-3-5-10(17)6-4-9/h3-6,8H,1-2H3