6-nitro-4-(3-oxidanylpropyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-nitro-4-(3-oxidanylpropyl)-1,4-benzoxazin-3-one Openeye Name: 4-(3-hydroxypropyl)-6-nitro-1,4-benzoxazin-3-one CAS Name: 4-(3-hydroxypropyl)-6-nitro-1,4-benzoxazin-3-one IUPAC Name: 4-(3-hydroxypropyl)-6-nitro-1,4-benzoxazin-3-one Traditional Name: 4-(3-hydroxypropyl)-6-nitro-1,4-benzoxazin-3-one Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CCCO

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CCCO

InChI

InChI=1S/C11H12N2O5/c14-5-1-4-12-9-6-8(13(16)17)2-3-10(9)18-7-11(12)15/h2-3,6,14H,1,4-5,7H2