4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[[2-(3-fluorophenyl)ethylamino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H18FN3 MolecularWeight: 271.332623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)CNCCC2=CC(=CC=C2)F

Isomeric SMILES

CC1=C(C=C(N1C)C#N)CNCCC2=CC(=CC=C2)F

InChI

InChI=1S/C16H18FN3/c1-12-14(9-16(10-18)20(12)2)11-19-7-6-13-4-3-5-15(17)8-13/h3-5,8-9,19H,6-7,11H2,1-2H3