N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-cyclohexanecarboxamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-cyclohexanecarboxamide Openeye Name: N-allyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]cyclohexanecarboxamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enylcyclohexanecarboxamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enylcyclohexanecarboxamide Traditional Name: N-allyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]cyclohexanecarboxamide Formula: C22H27FN2O MolecularWeight: 354.460983

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3CCCCC3

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3CCCCC3

InChI

InChI=1S/C22H27FN2O/c1-2-13-25(22(26)19-9-4-3-5-10-19)17-21-12-7-14-24(21)16-18-8-6-11-20(23)15-18/h2,6-8,11-12,14-15,19H,1,3-5,9-10,13,16-17H2