2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazino]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C22H25FN4O5 MolecularWeight: 444.456103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O5/c1-15(22(29)24-19-14-18(27(30)31)7-8-20(19)32-2)25-9-11-26(12-10-25)21(28)13-16-3-5-17(23)6-4-16/h3-8,14-15H,9-13H2,1-2H3,(H,24,29)