tert-butyl (3R)-3-(phenylmethoxycarbonylamino)octanoate

Systemtic Name: tert-butyl (3R)-3-(phenylmethoxycarbonylamino)octanoate Openeye Name: tert-butyl (3R)-3-(benzyloxycarbonylamino)octanoate CAS Name: (3R)-3-(phenylmethoxycarbonylamino)octanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-(phenylmethoxycarbonylamino)octanoate Traditional Name: (3R)-3-(benzyloxycarbonylamino)caprylic acid tert-butyl ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC[C@H](CC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H31NO4/c1-5-6-8-13-17(14-18(22)25-20(2,3)4)21-19(23)24-15-16-11-9-7-10-12-16/h7,9-12,17H,5-6,8,13-15H2,1-4H3,(H,21,23)/t17-/m1/s1