N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-1-(4-nitrophenyl)methanimine

Systemtic Name: N-[2-(2-chloranyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-1-(4-nitrophenyl)methanimine Openeye Name: N-[2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-1-(4-nitrophenyl)methanimine CAS Name: N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-1-(4-nitrophenyl)methanimine IUPAC Name: N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-1-(4-nitrophenyl)methanimine Traditional Name: [2-(2-chloro-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-(4-nitrobenzylidene)amine Formula: C20H11ClIN3O3 MolecularWeight: 503.67711

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H11ClIN3O3/c21-17-7-3-13(22)9-16(17)20-24-18-10-14(4-8-19(18)28-20)23-11-12-1-5-15(6-2-12)25(26)27/h1-11H