N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3-nitro-benzamide

Systemtic Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3-nitro-benzamide Openeye Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3-nitro-benzamide CAS Name: N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexyl-3-nitrobenzamide IUPAC Name: N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-3-nitrobenzamide Traditional Name: N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-3-nitro-benzamide Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26ClN3O3/c26-24-14-5-4-8-20(24)17-27-15-7-13-23(27)18-28(21-10-2-1-3-11-21)25(30)19-9-6-12-22(16-19)29(31)32/h4-9,12-16,21H,1-3,10-11,17-18H2