tert-butyl (2R)-6-(dimethylamino)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]hexanoate

Systemtic Name: tert-butyl (2R)-6-(dimethylamino)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]hexanoate Openeye Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-(dimethylamino)hexanoate CAS Name: (2R)-6-(dimethylamino)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-6-(dimethylamino)hexanoate Traditional Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-(dimethylamino)hexanoic acid tert-butyl ester Formula: C26H38N2O5S MolecularWeight: 490.65532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38N2O5S/c1-26(2,3)33-25(29)24(14-10-11-19-27(4)5)28(20-21-12-8-7-9-13-21)34(30,31)23-17-15-22(32-6)16-18-23/h7-9,12-13,15-18,24H,10-11,14,19-20H2,1-6H3/t24-/m1/s1