[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] (E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-enoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] (E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-enoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] (E)-4-oxo-4-(4-phenylpiperazin-1-yl)but-2-enoate CAS Name: (E)-4-oxo-4-(4-phenyl-1-piperazinyl)-2-butenoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] (E)-4-oxo-4-(4-phenylpiperazin-1-yl)but-2-enoate Traditional Name: (E)-4-keto-4-(4-phenylpiperazino)but-2-enoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C23H24FN3O4 MolecularWeight: 425.452763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C=CC(=O)OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)/C=C/C(=O)OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C23H24FN3O4/c24-19-8-6-18(7-9-19)16-25-21(28)17-31-23(30)11-10-22(29)27-14-12-26(13-15-27)20-4-2-1-3-5-20/h1-11H,12-17H2,(H,25,28)/b11-10+