N-tert-butyl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenyl-benzamide

Systemtic Name: N-tert-butyl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenyl-benzamide Openeye Name: N-tert-butyl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenyl-benzamide CAS Name: N-tert-butyl-N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-4-phenylbenzamide IUPAC Name: N-tert-butyl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-phenylbenzamide Traditional Name: N-tert-butyl-N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-4-phenyl-benzamide Formula: C29H29ClN2O MolecularWeight: 457.00636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

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