4-butoxy-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-butoxy-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-butoxy-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-isobutyl-benzamide CAS Name: 4-butoxy-N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-butoxy-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-butoxy-N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-N-isobutyl-benzamide Formula: C27H33ClN2O2 MolecularWeight: 453.01612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)CC(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)CC(C)C

InChI

InChI=1S/C27H33ClN2O2/c1-4-5-16-32-26-13-11-23(12-14-26)27(31)30(18-21(2)3)20-25-10-7-15-29(25)19-22-8-6-9-24(28)17-22/h6-15,17,21H,4-5,16,18-20H2,1-3H3