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

Systemtic Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: 4-ethoxy-3-nitro-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]benzamide CAS Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: 4-ethoxy-3-nitro-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]benzamide Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25N3O5/c1-4-16(3)18-8-12-23-21(14-18)28-26(34-23)17-6-10-20(11-7-17)27-25(30)19-9-13-24(33-5-2)22(15-19)29(31)32/h6-16H,4-5H2,1-3H3,(H,27,30)