methyl 2-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]ethanoate

Systemtic Name: methyl 2-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]ethanoate Openeye Name: methyl 2-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]acetate CAS Name: 2-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[benzyl-(4-tert-butylphenyl)sulfonylamino]acetate Traditional Name: 2-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]acetic acid methyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C20H25NO4S/c1-20(2,3)17-10-12-18(13-11-17)26(23,24)21(15-19(22)25-4)14-16-8-6-5-7-9-16/h5-13H,14-15H2,1-4H3