2-ethoxy-3-[4-[3-(2-methylpropoxy)-3-oxidanylidene-propoxy]phenyl]propanoic acid; 2-propylpentan-1-amine

Systemtic Name: 2-ethoxy-3-[4-[3-(2-methylpropoxy)-3-oxidanylidene-propoxy]phenyl]propanoic acid; 2-propylpentan-1-amine Openeye Name: 2-ethoxy-3-[4-(3-isobutoxy-3-oxo-propoxy)phenyl]propanoic acid; 2-propylpentan-1-amine CAS Name: 2-ethoxy-3-[4-[3-(2-methylpropoxy)-3-oxopropoxy]phenyl]propanoic acid; 2-propyl-1-pentanamine IUPAC Name: 2-ethoxy-3-[4-[3-(2-methylpropoxy)-3-oxopropoxy]phenyl]propanoic acid; 2-propylpentan-1-amine Traditional Name: 2-ethoxy-3-[4-(3-isobutoxy-3-keto-propoxy)phenyl]propionic acid; 2-propylpentylamine Formula: C26H45NO6 MolecularWeight: 467.6386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CN.CCOC(CC1=CC=C(C=C1)OCCC(=O)OCC(C)C)C(=O)O

Isomeric SMILES

CCCC(CCC)CN.CCOC(CC1=CC=C(C=C1)OCCC(=O)OCC(C)C)C(=O)O

InChI

InChI=1S/C18H26O6.C8H19N/c1-4-22-16(18(20)21)11-14-5-7-15(8-6-14)23-10-9-17(19)24-12-13(2)3;1-3-5-8(7-9)6-4-2/h5-8,13,16H,4,9-12H2,1-3H3,(H,20,21);8H,3-7,9H2,1-2H3