N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-])C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-])C3=CC=CC(=C3)C

InChI

InChI=1S/C21H24N4O5/c1-3-23(16-6-4-5-15(2)11-16)10-9-22-20(26)13-24-18-12-17(25(28)29)7-8-19(18)30-14-21(24)27/h4-8,11-12H,3,9-10,13-14H2,1-2H3,(H,22,26)