N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methoxyethyl)-4-pentyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC2=CC=CN2CC3=CC(=CC=C3)Cl

InChI

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