3-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide

Systemtic Name: 3-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: 3-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: 3-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: 3-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: 3-[4-[2-(4-fluorophenyl)acetyl]piperazino]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C22H25FN4O5 MolecularWeight: 444.456103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CCN2CCN(CC2)C(=O)CC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CCN2CCN(CC2)C(=O)CC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O5/c1-32-18-6-7-19(20(15-18)27(30)31)24-21(28)8-9-25-10-12-26(13-11-25)22(29)14-16-2-4-17(23)5-3-16/h2-7,15H,8-14H2,1H3,(H,24,28)