2-methyl-6-nitro-4-prop-2-ynyl-1,4-benzoxazin-3-one

Systemtic Name: 2-methyl-6-nitro-4-prop-2-ynyl-1,4-benzoxazin-3-one Openeye Name: 2-methyl-6-nitro-4-prop-2-ynyl-1,4-benzoxazin-3-one CAS Name: 2-methyl-6-nitro-4-prop-2-ynyl-1,4-benzoxazin-3-one IUPAC Name: 2-methyl-6-nitro-4-prop-2-ynyl-1,4-benzoxazin-3-one Traditional Name: 2-methyl-6-nitro-4-propargyl-1,4-benzoxazin-3-one Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC#C

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC#C

InChI

InChI=1S/C12H10N2O4/c1-3-6-13-10-7-9(14(16)17)4-5-11(10)18-8(2)12(13)15/h1,4-5,7-8H,6H2,2H3