5-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-1,5-oxazecane-6-carboxylic acid

Systemtic Name: 5-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-1,5-oxazecane-6-carboxylic acid Openeye Name: 5-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-1,5-oxazecane-6-carboxylic acid CAS Name: 5-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-1,5-oxazecane-6-carboxylic acid IUPAC Name: 5-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-1,5-oxazecane-6-carboxylic acid Traditional Name: 5-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-1,5-oxazecane-6-carboxylic acid Formula: C24H36N2O6 MolecularWeight: 448.55244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCOCCCCC2C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCOCCCCC2C(=O)O

InChI

InChI=1S/C24H36N2O6/c1-3-32-24(30)20(14-13-19-10-5-4-6-11-19)25-18(2)22(27)26-15-9-17-31-16-8-7-12-21(26)23(28)29/h4-6,10-11,18,20-21,25H,3,7-9,12-17H2,1-2H3,(H,28,29)