N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-3,4,5-trimethoxy-2-nitro-benzamide Formula: C20H19N3O7 MolecularWeight: 413.38076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4CC4)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4CC4)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H19N3O7/c1-27-15-9-12(16(23(25)26)18(29-3)17(15)28-2)19(24)21-11-6-7-14-13(8-11)22-20(30-14)10-4-5-10/h6-10H,4-5H2,1-3H3,(H,21,24)