4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylic acid

Systemtic Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-(9H-fluoren-9-ylmethoxycarbonylamino)azepane-4-carboxylic acid CAS Name: 4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-azepanecarboxylic acid IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-(9H-fluoren-9-ylmethoxycarbonylamino)azepane-4-carboxylic acid Formula: C27H32N2O6 MolecularWeight: 480.55278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(CC1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(CC1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C27H32N2O6/c1-26(2,3)35-25(33)29-15-8-13-27(14-16-29,23(30)31)28-24(32)34-17-22-20-11-6-4-9-18(20)19-10-5-7-12-21(19)22/h4-7,9-12,22H,8,13-17H2,1-3H3,(H,28,32)(H,30,31)