4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid

Systemtic Name: 4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid Openeye Name: 4-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid CAS Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid IUPAC Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid Traditional Name: 4-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-10-oxa-4-azaspiro[5.5]undecane-5-carboxylic acid Formula: C25H36N2O6 MolecularWeight: 460.56314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC3(C2C(=O)O)CCCOC3

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC3(C2C(=O)O)CCCOC3

InChI

InChI=1S/C25H36N2O6/c1-3-33-24(31)20(12-11-19-9-5-4-6-10-19)26-18(2)22(28)27-15-7-13-25(21(27)23(29)30)14-8-16-32-17-25/h4-6,9-10,18,20-21,26H,3,7-8,11-17H2,1-2H3,(H,29,30)