N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-5-nitro-2-furamide Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC(=CC(=C3O2)C)C)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC(=CC(=C3O2)C)C)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5/c1-11-8-13(3)19-16(9-11)23-21(29-19)14-5-4-12(2)15(10-14)22-20(25)17-6-7-18(28-17)24(26)27/h4-10H,1-3H3,(H,22,25)