N-[4-(7-bromanyl-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(7-bromanyl-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C26H23BrN4O5 MolecularWeight: 551.38862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=C1)Br)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C(=C1)Br)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C26H23BrN4O5/c1-2-16-13-20(27)24-21(14-16)29-26(36-24)17-3-6-19(7-4-17)28-25(32)18-5-8-22(23(15-18)31(33)34)30-9-11-35-12-10-30/h3-8,13-15H,2,9-12H2,1H3,(H,28,32)