3-[4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenoxy]propyl nitrate

Systemtic Name: 3-[4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenoxy]propyl nitrate Openeye Name: 3-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenoxy]propyl nitrate CAS Name: nitric acid 3-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenoxy]propyl ester IUPAC Name: 3-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenoxy]propyl nitrate Traditional Name: nitric acid 3-[4-(5-keto-3-methyl-2-pyrazolin-1-yl)phenoxy]propyl ester Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=C(C=C2)OCCCO[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=C(C=C2)OCCCO[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-10-9-13(17)15(14-10)11-3-5-12(6-4-11)20-7-2-8-21-16(18)19/h3-6H,2,7-9H2,1H3