N-[2-methyl-4-(2-morpholin-4-ylethyl)-3-oxidanylidene-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-methyl-4-(2-morpholin-4-ylethyl)-3-oxidanylidene-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide Openeye Name: N-[2-methyl-4-(2-morpholinoethyl)-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide CAS Name: N-[2-methyl-4-[2-(4-morpholinyl)ethyl]-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitrobenzamide IUPAC Name: N-[2-methyl-4-(2-morpholin-4-ylethyl)-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitrobenzamide Traditional Name: N-[3-keto-2-methyl-4-(2-morpholinoethyl)-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide Formula: C22H23N5O8 MolecularWeight: 485.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCN4CCOCC4

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCN4CCOCC4

InChI

InChI=1S/C22H23N5O8/c1-14-22(29)25(5-4-24-6-8-34-9-7-24)19-3-2-16(12-20(19)35-14)23-21(28)15-10-17(26(30)31)13-18(11-15)27(32)33/h2-3,10-14H,4-9H2,1H3,(H,23,28)