tert-butyl (2S)-3-cyclohexa-1,5-dien-1-yl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate

Systemtic Name: tert-butyl (2S)-3-cyclohexa-1,5-dien-1-yl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Openeye Name: tert-butyl (2S)-3-cyclohexa-1,5-dien-1-yl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate CAS Name: (2S)-3-(1-cyclohexa-1,5-dienyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-cyclohexa-1,5-dien-1-yl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Traditional Name: (2S)-3-cyclohexa-1,5-dien-1-yl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid tert-butyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CCCC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CCCC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C28H31NO4/c1-28(2,3)33-26(30)25(17-19-11-5-4-6-12-19)29-27(31)32-18-24-22-15-9-7-13-20(22)21-14-8-10-16-23(21)24/h5,7-16,24-25H,4,6,17-18H2,1-3H3,(H,29,31)/t25-/m0/s1