4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitropyridin-2-yl)amino]oxolan-2-one

Systemtic Name: 4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitropyridin-2-yl)amino]oxolan-2-one Openeye Name: 4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitro-2-pyridyl)amino]tetrahydrofuran-2-one CAS Name: 4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitro-2-pyridinyl)amino]-2-oxolanone IUPAC Name: 4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitropyridin-2-yl)amino]oxolan-2-one Traditional Name: 4-(1,3-dioxol-4-yl)-5-methyl-3-[(3-nitro-2-pyridyl)amino]tetrahydrofuran-2-one Formula: C13H13N3O6 MolecularWeight: 307.25882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)O1)NC2=C(C=CC=N2)[N+](=O)[O-])C3=COCO3

Isomeric SMILES

CC1C(C(C(=O)O1)NC2=C(C=CC=N2)[N+](=O)[O-])C3=COCO3

InChI

InChI=1S/C13H13N3O6/c1-7-10(9-5-20-6-21-9)11(13(17)22-7)15-12-8(16(18)19)3-2-4-14-12/h2-5,7,10-11H,6H2,1H3,(H,14,15)