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

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-benzamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide Traditional Name: N-benzyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-nitro-benzamide Formula: C26H22FN3O3 MolecularWeight: 443.469583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CN2CC3=CC(=CC=C3)F)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CN2CC3=CC(=CC=C3)F)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H22FN3O3/c27-23-11-4-9-21(15-23)18-28-14-6-13-25(28)19-29(17-20-7-2-1-3-8-20)26(31)22-10-5-12-24(16-22)30(32)33/h1-16H,17-19H2