5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one CAS Name: 5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one IUPAC Name: 5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 5-nitro-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzoxazol-2-one Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=N1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCCC1=NOC(=N1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C13H12N4O5/c1-2-3-11-14-12(22-15-11)7-16-9-6-8(17(19)20)4-5-10(9)21-13(16)18/h4-6H,2-3,7H2,1H3