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

Systemtic Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenyl-benzamide Openeye Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenyl-benzamide CAS Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-4-phenylbenzamide IUPAC Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenylbenzamide Traditional Name: N-butyl-N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-4-phenyl-benzamide Formula: C29H29ClN2O MolecularWeight: 457.00636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H29ClN2O/c1-2-3-19-32(22-27-13-9-20-31(27)21-26-12-7-8-14-28(26)30)29(33)25-17-15-24(16-18-25)23-10-5-4-6-11-23/h4-18,20H,2-3,19,21-22H2,1H3