4-[4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid

Systemtic Name: 4-[4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid Openeye Name: 4-[4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2-methoxy-5-nitro-phenoxy]butanoic acid CAS Name: 4-[4-[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]ethyl]-2-methoxy-5-nitrophenoxy]butanoic acid IUPAC Name: 4-[4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2-methoxy-5-nitrophenoxy]butanoic acid Traditional Name: 4-[4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2-methoxy-5-nitro-phenoxy]butyric acid Formula: C28H28N2O8 MolecularWeight: 520.53052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)[N+](=O)[O-])OCCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)[N+](=O)[O-])OCCCC(=O)O

InChI

InChI=1S/C28H28N2O8/c1-36-25-15-18(24(30(34)35)16-26(25)37-14-6-11-27(31)32)12-13-29-28(33)38-17-23-21-9-4-2-7-19(21)20-8-3-5-10-22(20)23/h2-5,7-10,15-16,23H,6,11-14,17H2,1H3,(H,29,33)(H,31,32)