(4-tert-butyl-2-methyl-phenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoate CAS Name: 4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoate Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butyric acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C23H31NO5S MolecularWeight: 433.56094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO5S/c1-17-16-18(23(2,3)4)9-14-21(17)29-22(25)8-7-15-24(5)30(26,27)20-12-10-19(28-6)11-13-20/h9-14,16H,7-8,15H2,1-6H3