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

Systemtic Name: N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-morpholino-5-nitro-benzamide Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCOCC5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCOCC5

InChI

InChI=1S/C25H22N4O5/c1-16-5-8-23-21(13-16)27-25(34-23)17-3-2-4-18(14-17)26-24(30)20-15-19(29(31)32)6-7-22(20)28-9-11-33-12-10-28/h2-8,13-15H,9-12H2,1H3,(H,26,30)