[methyl-[2-(propan-2-yloxycarbamoyl)octanoyl]amino] 3-phenylpropanoate

Systemtic Name: [methyl-[2-(propan-2-yloxycarbamoyl)octanoyl]amino] 3-phenylpropanoate Openeye Name: [2-(isopropoxycarbamoyl)octanoyl-methyl-amino] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [methyl-[1-oxo-2-[oxo-(propan-2-yloxyamino)methyl]octyl]amino] ester IUPAC Name: [methyl-[2-(propan-2-yloxycarbamoyl)octanoyl]amino] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-(isopropoxycarbamoyl)octanoyl-methyl-amino] ester Formula: C22H34N2O5 MolecularWeight: 406.51576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NOC(C)C)C(=O)N(C)OC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(C(=O)NOC(C)C)C(=O)N(C)OC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C22H34N2O5/c1-5-6-7-11-14-19(21(26)23-28-17(2)3)22(27)24(4)29-20(25)16-15-18-12-9-8-10-13-18/h8-10,12-13,17,19H,5-7,11,14-16H2,1-4H3,(H,23,26)