7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one

Systemtic Name: 7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Openeye Name: 7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one CAS Name: 7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one IUPAC Name: 7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Traditional Name: 7-nitro-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)[N+](=O)[O-])CCCOC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)[N+](=O)[O-])CCCOC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O5/c20-17-12-24-16-11-13(19(21)22)7-8-15(16)18(17)9-4-10-23-14-5-2-1-3-6-14/h1-3,5-8,11H,4,9-10,12H2