4-butoxy-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-benzamide

Systemtic Name: 4-butoxy-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-benzamide Openeye Name: 4-butoxy-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-benzamide CAS Name: 4-butoxy-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexylbenzamide IUPAC Name: 4-butoxy-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexylbenzamide Traditional Name: 4-butoxy-N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-benzamide Formula: C29H35ClN2O2 MolecularWeight: 479.0534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

InChI

InChI=1S/C29H35ClN2O2/c1-2-3-20-34-27-17-15-23(16-18-27)29(33)32(25-11-5-4-6-12-25)22-26-13-9-19-31(26)21-24-10-7-8-14-28(24)30/h7-10,13-19,25H,2-6,11-12,20-22H2,1H3