[4-[[5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-2-methoxy-phenyl] 2-iodanylbenzoate

Systemtic Name: [4-[[5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-2-methoxy-phenyl] 2-iodanylbenzoate Openeye Name: [4-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-2-methoxy-phenyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [4-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-2-methoxyphenyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [4-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-2-methoxy-phenyl] ester Formula: C29H20ClIN2O4 MolecularWeight: 622.83757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)N=CC4=CC(=C(C=C4)OC(=O)C5=CC=CC=C5I)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)N=CC4=CC(=C(C=C4)OC(=O)C5=CC=CC=C5I)OC

InChI

InChI=1S/C29H20ClIN2O4/c1-17-7-9-19(28-33-24-15-20(30)10-12-25(24)36-28)14-23(17)32-16-18-8-11-26(27(13-18)35-2)37-29(34)21-5-3-4-6-22(21)31/h3-16H,1-2H3