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

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-dodecanamide Openeye Name: N-allyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]dodecanamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enyldodecanamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyldodecanamide Traditional Name: N-allyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]lauramide Formula: C27H39FN2O MolecularWeight: 426.609763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N(CC=C)CC1=CC=CN1CC2=CC(=CC=C2)F

Isomeric SMILES

CCCCCCCCCCCC(=O)N(CC=C)CC1=CC=CN1CC2=CC(=CC=C2)F

InChI

InChI=1S/C27H39FN2O/c1-3-5-6-7-8-9-10-11-12-18-27(31)30(19-4-2)23-26-17-14-20-29(26)22-24-15-13-16-25(28)21-24/h4,13-17,20-21H,2-3,5-12,18-19,22-23H2,1H3