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

Systemtic Name: N-[2-chloranyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-chloro-5-(5-isopropyl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[2-chloro-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[2-chloro-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-chloro-5-(5-isopropyl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C25H22ClN3O5 MolecularWeight: 479.91228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C(C)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C(C)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H22ClN3O5/c1-4-33-23-10-7-16(13-21(23)29(31)32)24(30)27-19-12-17(5-8-18(19)26)25-28-20-11-15(14(2)3)6-9-22(20)34-25/h5-14H,4H2,1-3H3,(H,27,30)