2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; propyl N-(4-methylpentyl)carbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; propyl N-(4-methylpentyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; propyl N-isohexylcarbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(4-methylpentyl)carbamic acid propyl ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; propyl N-(4-methylpentyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-isohexylcarbamic acid propyl ester Formula: C23H39NO6 MolecularWeight: 425.55886

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NCCCC(C)C.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCCOC(=O)NCCCC(C)C.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C13H18O4.C10H21NO2/c1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2;1-4-8-13-10(12)11-7-5-6-9(2)3/h5-8,12H,3-4,9H2,1-2H3,(H,14,15);9H,4-8H2,1-3H3,(H,11,12)