7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one

Systemtic Name: 7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Openeye Name: 7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one CAS Name: 7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one IUPAC Name: 7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Traditional Name: 7-nitro-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)OC2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)O2

Isomeric SMILES

CCCC(C1=CC=CC=C1)OC2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)O2

InChI

InChI=1S/C18H16N2O5/c1-2-6-16(12-7-4-3-5-8-12)24-18-19-15-11-13(20(22)23)9-10-14(15)17(21)25-18/h3-5,7-11,16H,2,6H2,1H3