N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclopropyl-adamantane-1-carboxamide

Systemtic Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclopropyl-adamantane-1-carboxamide Openeye Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclopropyl-adamantane-1-carboxamide CAS Name: N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclopropyl-1-adamantanecarboxamide IUPAC Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclopropyladamantane-1-carboxamide Traditional Name: N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-N-cyclopropyl-adamantane-1-carboxamide Formula: C26H31ClN2O MolecularWeight: 422.99014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC1N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H31ClN2O/c27-24-6-2-1-4-21(24)16-28-9-3-5-23(28)17-29(22-7-8-22)25(30)26-13-18-10-19(14-26)12-20(11-18)15-26/h1-6,9,18-20,22H,7-8,10-17H2