4-tert-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide

Systemtic Name: 4-tert-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide Openeye Name: 4-tert-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide CAS Name: 4-tert-butyl-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-propylbenzamide IUPAC Name: 4-tert-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-propylbenzamide Traditional Name: 4-tert-butyl-N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-N-propyl-benzamide Formula: C26H31ClN2O MolecularWeight: 422.99014

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H31ClN2O/c1-5-16-29(25(30)20-12-14-22(15-13-20)26(2,3)4)19-23-10-8-17-28(23)18-21-9-6-7-11-24(21)27/h6-15,17H,5,16,18-19H2,1-4H3