4-(aminomethyl)-4-[3-chloranyl-2,4-bis(fluoranyl)phenyl]pyrrole-3-carbonitrile

Systemtic Name: 4-(aminomethyl)-4-[3-chloranyl-2,4-bis(fluoranyl)phenyl]pyrrole-3-carbonitrile Openeye Name: 4-(aminomethyl)-4-(3-chloro-2,4-difluoro-phenyl)pyrrole-3-carbonitrile CAS Name: 4-(aminomethyl)-4-(3-chloro-2,4-difluorophenyl)-3-pyrrolecarbonitrile IUPAC Name: 4-(aminomethyl)-4-(3-chloro-2,4-difluorophenyl)pyrrole-3-carbonitrile Traditional Name: 4-(aminomethyl)-4-(3-chloro-2,4-difluoro-phenyl)pyrrole-3-carbonitrile Formula: C12H8ClF2N3 MolecularWeight: 267.661826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C2(C=NC=C2C#N)CN)F)Cl)F

Isomeric SMILES

C1=CC(=C(C(=C1C2(C=NC=C2C#N)CN)F)Cl)F

InChI

InChI=1S/C12H8ClF2N3/c13-10-9(14)2-1-8(11(10)15)12(5-17)6-18-4-7(12)3-16/h1-2,4,6H,5,17H2