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

Systemtic Name: tert-butyl (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-(benzyloxycarbonylamino)hexanoate CAS Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-6-(phenylmethoxycarbonylamino)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-(benzyloxycarbonylamino)hexanoic acid tert-butyl ester Formula: C32H40N2O7S MolecularWeight: 596.7342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](CCCCNC(=O)OCC1=CC=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C32H40N2O7S/c1-32(2,3)41-30(35)29(17-11-12-22-33-31(36)40-24-26-15-9-6-10-16-26)34(23-25-13-7-5-8-14-25)42(37,38)28-20-18-27(39-4)19-21-28/h5-10,13-16,18-21,29H,11-12,17,22-24H2,1-4H3,(H,33,36)/t29-/m1/s1