tert-butyl (2S)-2-[(diphenylmethylidene)amino]-3-[5-(phenylsulfonyloxy)pyridin-2-yl]propanoate

Systemtic Name: tert-butyl (2S)-2-[(diphenylmethylidene)amino]-3-[5-(phenylsulfonyloxy)pyridin-2-yl]propanoate Openeye Name: tert-butyl (2S)-3-[5-(benzenesulfonyloxy)-2-pyridyl]-2-(benzhydrylideneamino)propanoate CAS Name: (2S)-3-[5-(benzenesulfonyloxy)-2-pyridinyl]-2-[(diphenylmethylene)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-[5-(benzenesulfonyloxy)pyridin-2-yl]-2-(benzhydrylideneamino)propanoate Traditional Name: (2S)-2-(benzhydrylideneamino)-3-(5-besyloxy-2-pyridyl)propionic acid tert-butyl ester Formula: C31H30N2O5S MolecularWeight: 542.6453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=NC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)N=C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=NC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)N=C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H30N2O5S/c1-31(2,3)37-30(34)28(33-29(23-13-7-4-8-14-23)24-15-9-5-10-16-24)21-25-19-20-26(22-32-25)38-39(35,36)27-17-11-6-12-18-27/h4-20,22,28H,21H2,1-3H3/t28-/m0/s1