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

Systemtic Name: 4-chloranyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-isobutyl-3-nitro-benzamide CAS Name: 4-chloro-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-N-isobutyl-3-nitro-benzamide Formula: C23H23ClFN3O3 MolecularWeight: 443.898423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClFN3O3/c1-16(2)13-27(23(29)18-8-9-21(24)22(12-18)28(30)31)15-20-7-4-10-26(20)14-17-5-3-6-19(25)11-17/h3-12,16H,13-15H2,1-2H3