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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

InChI

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