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

Systemtic Name: N-[4-(2-morpholin-4-ylethyl)-3-oxidanylidene-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide Openeye Name: N-[4-(2-morpholinoethyl)-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide CAS Name: N-[4-[2-(4-morpholinyl)ethyl]-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(2-morpholin-4-ylethyl)-3-oxo-1,4-benzoxazin-7-yl]-3,5-dinitrobenzamide Traditional Name: N-[3-keto-4-(2-morpholinoethyl)-1,4-benzoxazin-7-yl]-3,5-dinitro-benzamide Formula: C21H21N5O8 MolecularWeight: 471.42014

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C(=O)COC3=C2C=CC(=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN2C(=O)COC3=C2C=CC(=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O8/c27-20-13-34-19-11-15(1-2-18(19)24(20)4-3-23-5-7-33-8-6-23)22-21(28)14-9-16(25(29)30)12-17(10-14)26(31)32/h1-2,9-12H,3-8,13H2,(H,22,28)