5-[2-chloranyl-4-(3-chloranyl-4-phenylmethoxy-phenyl)sulfonyl-phenoxy]-2-methyl-6-nitro-1,3-benzoxazole

Systemtic Name: 5-[2-chloranyl-4-(3-chloranyl-4-phenylmethoxy-phenyl)sulfonyl-phenoxy]-2-methyl-6-nitro-1,3-benzoxazole Openeye Name: 5-[4-(4-benzyloxy-3-chloro-phenyl)sulfonyl-2-chloro-phenoxy]-2-methyl-6-nitro-1,3-benzoxazole CAS Name: 5-[2-chloro-4-(3-chloro-4-phenylmethoxyphenyl)sulfonylphenoxy]-2-methyl-6-nitro-1,3-benzoxazole IUPAC Name: 5-[2-chloro-4-(3-chloro-4-phenylmethoxyphenyl)sulfonylphenoxy]-2-methyl-6-nitro-1,3-benzoxazole Traditional Name: 5-[4-(4-benzoxy-3-chloro-phenyl)sulfonyl-2-chloro-phenoxy]-2-methyl-6-nitro-1,3-benzoxazole Formula: C27H18Cl2N2O7S MolecularWeight: 585.41202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2O1)[N+](=O)[O-])OC3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)OCC5=CC=CC=C5)Cl)Cl

Isomeric SMILES

CC1=NC2=CC(=C(C=C2O1)[N+](=O)[O-])OC3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)OCC5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C27H18Cl2N2O7S/c1-16-30-22-13-27(23(31(32)33)14-26(22)37-16)38-25-10-8-19(12-21(25)29)39(34,35)18-7-9-24(20(28)11-18)36-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3