1-[2-[[1-ethoxy-10-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanylidene-decan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[1-ethoxy-10-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanylidene-decan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[9-(tert-butoxycarbonylamino)-1-ethoxycarbonyl-nonyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[1-ethoxy-10-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxodecan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[1-ethoxy-10-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxodecan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[9-(tert-butoxycarbonylamino)-1-carbethoxy-nonyl]amino]propanoyl]proline Formula: C25H45N3O7 MolecularWeight: 499.6407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCCCNC(=O)OC(C)(C)C)NC(C)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CCOC(=O)C(CCCCCCCCNC(=O)OC(C)(C)C)NC(C)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C25H45N3O7/c1-6-34-23(32)19(27-18(2)21(29)28-17-13-15-20(28)22(30)31)14-11-9-7-8-10-12-16-26-24(33)35-25(3,4)5/h18-20,27H,6-17H2,1-5H3,(H,26,33)(H,30,31)