N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3,5-dimethoxy-benzamide

Systemtic Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3,5-dimethoxy-benzamide Openeye Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3,5-dimethoxy-benzamide CAS Name: N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexyl-3,5-dimethoxybenzamide IUPAC Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3,5-dimethoxybenzamide Traditional Name: N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-3,5-dimethoxy-benzamide Formula: C27H31BrN2O3 MolecularWeight: 511.45064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31BrN2O3/c1-32-25-15-21(16-26(17-25)33-2)27(31)30(23-7-4-3-5-8-23)19-24-9-6-14-29(24)18-20-10-12-22(28)13-11-20/h6,9-17,23H,3-5,7-8,18-19H2,1-2H3