(2,6-dimethylphenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate

Systemtic Name: (2,6-dimethylphenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate Openeye Name: (2,6-dimethylphenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate CAS Name: 4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoate Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butyric acid (2,6-dimethylphenyl) ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H25NO5S/c1-15-7-5-8-16(2)20(15)26-19(22)9-6-14-21(3)27(23,24)18-12-10-17(25-4)11-13-18/h5,7-8,10-13H,6,9,14H2,1-4H3