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2-methoxy-6-nitro-4-[(E)-2-(4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)ethenyl]phenolate

2-methoxy-6-nitro-4-[(E)-2-(4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)ethenyl]phenolate

Systemtic Name:2-methoxy-6-nitro-4-[(E)-2-(4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)ethenyl]phenolate
Openeye Name:4-[(E)-2-(2-isopropyl-4-oxo-1H-pyrimidin-6-yl)vinyl]-2-methoxy-6-nitro-phenolate
CAS Name:2-methoxy-6-nitro-4-[(E)-2-(4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)ethenyl]phenolate
IUPAC Name:2-methoxy-6-nitro-4-[(E)-2-(4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)ethenyl]phenolate
Traditional Name:4-[(E)-2-(2-isopropyl-4-keto-1H-pyrimidin-6-yl)vinyl]-2-methoxy-6-nitro-phenolate
Formula: C16H16N3O5-
MolecularWeight: 330.31534
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)C=C(N1)C=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]


Isomeric SMILES

CC(C)C1=NC(=O)C=C(N1)/C=C/C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]


InChI

InChI=1S/C16H17N3O5/c1-9(2)16-17-11(8-14(20)18-16)5-4-10-6-12(19(22)23)15(21)13(7-10)24-3/h4-9,21H,1-3H3,(H,17,18,20)/p-1/b5-4+


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