4-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl-phenylmethoxy-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl-phenylmethoxy-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[benzyloxy-[5-(tert-butoxycarbonylamino)pentyl]amino]-4-oxo-butanoic acid CAS Name: 4-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentyl-phenylmethoxyamino]-4-oxobutanoic acid IUPAC Name: 4-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl-phenylmethoxyamino]-4-oxobutanoic acid Traditional Name: 4-[benzoxy-[5-(tert-butoxycarbonylamino)pentyl]amino]-4-keto-butyric acid Formula: C21H32N2O6 MolecularWeight: 408.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCN(C(=O)CCC(=O)O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCN(C(=O)CCC(=O)O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H32N2O6/c1-21(2,3)29-20(27)22-14-8-5-9-15-23(18(24)12-13-19(25)26)28-16-17-10-6-4-7-11-17/h4,6-7,10-11H,5,8-9,12-16H2,1-3H3,(H,22,27)(H,25,26)