ethyl 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenyldiazenyl-phenyl]sulfonylpropanoate

Systemtic Name: ethyl 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenyldiazenyl-phenyl]sulfonylpropanoate Openeye Name: ethyl 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenylazo-phenyl]sulfonylpropanoate CAS Name: 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenyldiazenylphenyl]sulfonylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenyldiazenylphenyl]sulfonylpropanoate Traditional Name: 3-[3-[2-hydroxyethyl(methyl)amino]-4-phenylazo-phenyl]sulfonylpropionic acid ethyl ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCS(=O)(=O)C1=CC(=C(C=C1)N=NC2=CC=CC=C2)N(C)CCO

Isomeric SMILES

CCOC(=O)CCS(=O)(=O)C1=CC(=C(C=C1)N=NC2=CC=CC=C2)N(C)CCO

InChI

InChI=1S/C20H25N3O5S/c1-3-28-20(25)11-14-29(26,27)17-9-10-18(19(15-17)23(2)12-13-24)22-21-16-7-5-4-6-8-16/h4-10,15,24H,3,11-14H2,1-2H3