4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]benzoate

Systemtic Name: 4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]benzoate Openeye Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoate CAS Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoate IUPAC Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoate Traditional Name: 4-[(4-keto-6-propyl-1H-pyrimidin-2-yl)amino]benzoate Formula: C14H14N3O3- MolecularWeight: 272.27926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H15N3O3/c1-2-3-11-8-12(18)17-14(16-11)15-10-6-4-9(5-7-10)13(19)20/h4-8H,2-3H2,1H3,(H,19,20)(H2,15,16,17,18)/p-1