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7-nitro-2-(oxan-2-ylmethyl)phthalazin-1-one

7-nitro-2-(oxan-2-ylmethyl)phthalazin-1-one

Systemtic Name:7-nitro-2-(oxan-2-ylmethyl)phthalazin-1-one
Openeye Name:7-nitro-2-(tetrahydropyran-2-ylmethyl)phthalazin-1-one
CAS Name:7-nitro-2-(2-oxanylmethyl)-1-phthalazinone
IUPAC Name:7-nitro-2-(oxan-2-ylmethyl)phthalazin-1-one
Traditional Name:7-nitro-2-(tetrahydropyran-2-ylmethyl)phthalazin-1-one
Formula: C14H15N3O4
MolecularWeight: 289.2866
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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CN2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C=N2


Isomeric SMILES

C1CCOC(C1)CN2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C=N2


InChI

InChI=1S/C14H15N3O4/c18-14-13-7-11(17(19)20)5-4-10(13)8-15-16(14)9-12-3-1-2-6-21-12/h4-5,7-8,12H,1-3,6,9H2


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