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

Systemtic Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[3-(5,7-dimethyl-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:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCOCC5)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCOCC5)C)C

InChI

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