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

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-adamantane-1-carboxamide Openeye Name: N-allyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enyl-1-adamantanecarboxamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyladamantane-1-carboxamide Traditional Name: N-allyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide Formula: C26H31FN2O MolecularWeight: 406.535543

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31FN2O/c1-2-8-29(25(30)26-14-20-10-21(15-26)12-22(11-20)16-26)18-24-7-4-9-28(24)17-19-5-3-6-23(27)13-19/h2-7,9,13,20-22H,1,8,10-12,14-18H2