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

Systemtic Name: N-[3-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C22H16ClN3O5 MolecularWeight: 437.83254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16ClN3O5/c1-2-30-20-8-6-13(11-18(20)26(28)29)21(27)24-16-5-3-4-14(10-16)22-25-17-12-15(23)7-9-19(17)31-22/h3-12H,2H2,1H3,(H,24,27)