4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-1,4-oxazecane-3-carboxylic acid

Systemtic Name: 4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-1,4-oxazecane-3-carboxylic acid Openeye Name: 4-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-1,4-oxazecane-3-carboxylic acid CAS Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-1,4-oxazecane-3-carboxylic acid IUPAC Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-1,4-oxazecane-3-carboxylic acid Traditional Name: 4-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-1,4-oxazecane-3-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)N2CCCCCCOCC2C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCCCCOCC2C(=O)O

InChI

InChI=1S/C24H36N2O6/c1-3-32-24(30)20(14-13-19-11-7-6-8-12-19)25-18(2)22(27)26-15-9-4-5-10-16-31-17-21(26)23(28)29/h6-8,11-12,18,20-21,25H,3-5,9-10,13-17H2,1-2H3,(H,28,29)