4-[2-(2-cyclohexylimino-4-methyl-pyridin-1-yl)-2-oxidanylidene-ethyl]-6-nitro-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-(2-cyclohexylimino-4-methyl-pyridin-1-yl)-2-oxidanylidene-ethyl]-6-nitro-1,4-benzoxazin-3-one Openeye Name: 4-[2-(2-cyclohexylimino-4-methyl-1-pyridyl)-2-oxo-ethyl]-6-nitro-1,4-benzoxazin-3-one CAS Name: 4-[2-(2-cyclohexylimino-4-methyl-1-pyridinyl)-2-oxoethyl]-6-nitro-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(2-cyclohexylimino-4-methylpyridin-1-yl)-2-oxoethyl]-6-nitro-1,4-benzoxazin-3-one Traditional Name: 4-[2-(2-cyclohexylimino-4-methyl-1-pyridyl)-2-keto-ethyl]-6-nitro-1,4-benzoxazin-3-one Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-15-9-10-24(20(11-15)23-16-5-3-2-4-6-16)21(27)13-25-18-12-17(26(29)30)7-8-19(18)31-14-22(25)28/h7-12,16H,2-6,13-14H2,1H3