2-(2-methoxyethoxy)ethyl 2-[[5-(2-chloranyl-4-methylsulfonyl-phenoxy)-2-nitro-phenyl]amino]propanoate

Systemtic Name: 2-(2-methoxyethoxy)ethyl 2-[[5-(2-chloranyl-4-methylsulfonyl-phenoxy)-2-nitro-phenyl]amino]propanoate Openeye Name: 2-(2-methoxyethoxy)ethyl 2-[5-(2-chloro-4-methylsulfonyl-phenoxy)-2-nitro-anilino]propanoate CAS Name: 2-[5-(2-chloro-4-methylsulfonylphenoxy)-2-nitroanilino]propanoic acid 2-(2-methoxyethoxy)ethyl ester IUPAC Name: 2-(2-methoxyethoxy)ethyl 2-[5-(2-chloro-4-methylsulfonylphenoxy)-2-nitroanilino]propanoate Traditional Name: 2-[5-(2-chloro-4-mesyl-phenoxy)-2-nitro-anilino]propionic acid 2-(2-methoxyethoxy)ethyl ester Formula: C21H25ClN2O9S MolecularWeight: 516.9492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOCCOC)NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OCCOCCOC)NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN2O9S/c1-14(21(25)32-11-10-31-9-8-30-2)23-18-12-15(4-6-19(18)24(26)27)33-20-7-5-16(13-17(20)22)34(3,28)29/h4-7,12-14,23H,8-11H2,1-3H3