ethyl 3-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-6,7-dimethyl-quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-6,7-dimethyl-quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-6,7-dimethyl-quinoxaline-2-carboxylate CAS Name: 3-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]-6,7-dimethyl-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-6,7-dimethylquinoxaline-2-carboxylate Traditional Name: 3-[4-[2-(4-fluorophenyl)acetyl]piperazino]-6,7-dimethyl-quinoxaline-2-carboxylic acid ethyl ester Formula: C25H27FN4O3 MolecularWeight: 450.505283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=C(C(=C2)C)C)N=C1N3CCN(CC3)C(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=C(C(=C2)C)C)N=C1N3CCN(CC3)C(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN4O3/c1-4-33-25(32)23-24(28-21-14-17(3)16(2)13-20(21)27-23)30-11-9-29(10-12-30)22(31)15-18-5-7-19(26)8-6-18/h5-8,13-14H,4,9-12,15H2,1-3H3