[4-(4-bromanyl-3-nitro-phenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-yl-methanone

Systemtic Name: [4-(4-bromanyl-3-nitro-phenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-yl-methanone Openeye Name: [4-(4-bromo-3-nitro-benzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholino-methanone CAS Name: [4-[(4-bromo-3-nitrophenyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-morpholinyl)methanone IUPAC Name: [4-(4-bromo-3-nitrobenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-ylmethanone Traditional Name: [4-(4-bromo-3-nitro-benzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholino-methanone Formula: C20H18BrN3O6 MolecularWeight: 476.27742

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H18BrN3O6/c21-14-6-5-13(11-16(14)24(27)28)19(25)23-12-18(20(26)22-7-9-29-10-8-22)30-17-4-2-1-3-15(17)23/h1-6,11,18H,7-10,12H2