tert-butyl (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4,4-dimethyl-pentanoate

Systemtic Name: tert-butyl (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4,4-dimethyl-pentanoate Openeye Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-4,4-dimethyl-pentanoate CAS Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4,4-dimethylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-4,4-dimethylpentanoate Traditional Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-4,4-dimethyl-valeric acid tert-butyl ester Formula: C25H35NO5S MolecularWeight: 461.6141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C[C@H](C(=O)OC(C)(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C25H35NO5S/c1-24(2,3)17-22(23(27)31-25(4,5)6)26(18-19-11-9-8-10-12-19)32(28,29)21-15-13-20(30-7)14-16-21/h8-16,22H,17-18H2,1-7H3/t22-/m1/s1