ethyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-(3-nitrophenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-(3-nitrophenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-(3-nitrophenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-4-(3-nitrophenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-(3-nitrophenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-6-keto-4-(3-nitrophenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H24FN5O5 MolecularWeight: 469.465563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H24FN5O5/c1-2-34-22(31)19-20(15-4-3-5-18(14-15)29(32)33)25-23(26-21(19)30)28-12-10-27(11-13-28)17-8-6-16(24)7-9-17/h3-9,14,19-20H,2,10-13H2,1H3,(H,25,26,30)