1-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]proline Formula: C35H39N3O6 MolecularWeight: 597.70066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CCC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C35H39N3O6/c1-3-22(2)31(33(40)38-19-11-18-30(38)34(41)42)37-32(39)29(20-23-12-5-4-6-13-23)36-35(43)44-21-28-26-16-9-7-14-24(26)25-15-8-10-17-27(25)28/h4-10,12-17,22,28-31H,3,11,18-21H2,1-2H3,(H,36,43)(H,37,39)(H,41,42)