N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,4-dimethoxy-benzamide

Systemtic Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,4-dimethoxy-benzamide Openeye Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,4-dimethoxy-benzamide CAS Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-2,4-dimethoxybenzamide IUPAC Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,4-dimethoxybenzamide Traditional Name: N-cyclohexyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-2,4-dimethoxy-benzamide Formula: C27H31FN2O3 MolecularWeight: 450.545043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4)OC

InChI

InChI=1S/C27H31FN2O3/c1-32-24-13-14-25(26(17-24)33-2)27(31)30(22-10-4-3-5-11-22)19-23-12-7-15-29(23)18-20-8-6-9-21(28)16-20/h6-9,12-17,22H,3-5,10-11,18-19H2,1-2H3