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

Systemtic Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-2-morpholino-5-nitro-benzamide Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O5/c1-3-18-5-9-25-23(14-18)29-27(36-25)19-6-4-17(2)22(15-19)28-26(32)21-16-20(31(33)34)7-8-24(21)30-10-12-35-13-11-30/h4-9,14-16H,3,10-13H2,1-2H3,(H,28,32)