2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-ethyl-amino]ethyl 4-fluoranylbenzoate

Systemtic Name: 2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-ethyl-amino]ethyl 4-fluoranylbenzoate Openeye Name: 2-[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)-ethyl-amino]ethyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 2-[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-ethylamino]ethyl ester IUPAC Name: 2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-ethylamino]ethyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 2-[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)-ethyl-amino]ethyl ester Formula: C17H20FN3O4 MolecularWeight: 349.356803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC(=O)C1=CC=C(C=C1)F)C2=CC(=O)N(C(=O)N2C)C

Isomeric SMILES

CCN(CCOC(=O)C1=CC=C(C=C1)F)C2=CC(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H20FN3O4/c1-4-21(14-11-15(22)20(3)17(24)19(14)2)9-10-25-16(23)12-5-7-13(18)8-6-12/h5-8,11H,4,9-10H2,1-3H3