[2-[[4-[(2-methoxyphenyl)diazenyl]-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-[[4-[(2-methoxyphenyl)diazenyl]-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)sulfonylamino]propanoate Openeye Name: [2-[4-(2-methoxyphenyl)azo-3-methyl-anilino]-2-oxo-ethyl] 2-[(2-fluorophenyl)sulfonylamino]propanoate CAS Name: 2-[(2-fluorophenyl)sulfonylamino]propanoic acid [2-[4-(2-methoxyphenyl)azo-3-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2-methoxyphenyl)diazenyl]-3-methylanilino]-2-oxoethyl] 2-[(2-fluorophenyl)sulfonylamino]propanoate Traditional Name: 2-[(2-fluorophenyl)sulfonylamino]propionic acid [2-keto-2-[4-(2-methoxyphenyl)azo-3-methyl-anilino]ethyl] ester Formula: C25H25FN4O6S MolecularWeight: 528.552603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(C)NS(=O)(=O)C2=CC=CC=C2F)N=NC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(C)NS(=O)(=O)C2=CC=CC=C2F)N=NC3=CC=CC=C3OC

InChI

InChI=1S/C25H25FN4O6S/c1-16-14-18(12-13-20(16)28-29-21-9-5-6-10-22(21)35-3)27-24(31)15-36-25(32)17(2)30-37(33,34)23-11-7-4-8-19(23)26/h4-14,17,30H,15H2,1-3H3,(H,27,31)