6-[4-[[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]phenyl]hexanoic acid

Systemtic Name: 6-[4-[[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]phenyl]hexanoic acid Openeye Name: 6-[4-[(5-bromo-2,4-dioxo-pyrimidin-1-yl)methyl]phenyl]hexanoic acid CAS Name: 6-[4-[(5-bromo-2,4-dioxo-1-pyrimidinyl)methyl]phenyl]hexanoic acid IUPAC Name: 6-[4-[(5-bromo-2,4-dioxopyrimidin-1-yl)methyl]phenyl]hexanoic acid Traditional Name: 6-[4-[(5-bromo-2,4-diketo-pyrimidin-1-yl)methyl]phenyl]hexanoic acid Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCC(=O)O)CN2C=C(C(=O)NC2=O)Br

Isomeric SMILES

C1=CC(=CC=C1CCCCCC(=O)O)CN2C=C(C(=O)NC2=O)Br

InChI

InChI=1S/C17H19BrN2O4/c18-14-11-20(17(24)19-16(14)23)10-13-8-6-12(7-9-13)4-2-1-3-5-15(21)22/h6-9,11H,1-5,10H2,(H,21,22)(H,19,23,24)