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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC=CC=C3Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC=CC=C3Cl

InChI

InChI=1S/C27H33ClN2O2/c1-3-4-9-22-13-15-23(16-14-22)27(31)30(18-8-19-32-2)21-25-11-7-17-29(25)20-24-10-5-6-12-26(24)28/h5-7,10-17H,3-4,8-9,18-21H2,1-2H3