N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-propyl-benzamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-propyl-benzamide Openeye Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-propyl-benzamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-4-methyl-3-nitro-N-propylbenzamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-propylbenzamide Traditional Name: N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-propyl-benzamide Formula: C23H24FN3O3 MolecularWeight: 409.453363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H24FN3O3/c1-3-11-26(23(28)19-10-9-17(2)22(14-19)27(29)30)16-21-8-5-12-25(21)15-18-6-4-7-20(24)13-18/h4-10,12-14H,3,11,15-16H2,1-2H3