3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxy-propanoic acid; (2-methoxyphenyl) carbamate

Systemtic Name: 3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxy-propanoic acid; (2-methoxyphenyl) carbamate Openeye Name: 3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxy-propanoic acid; (2-methoxyphenyl) carbamate CAS Name: carbamic acid (2-methoxyphenyl) ester; 3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxypropanoic acid; (2-methoxyphenyl) carbamate Traditional Name: carbamic acid (2-methoxyphenyl) ester; 3-[4-(4-cyclopentylbutoxy)phenyl]-2-ethoxy-propionic acid Formula: C28H39NO7 MolecularWeight: 501.61176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCCCC2CCCC2)C(=O)O.COC1=CC=CC=C1OC(=O)N

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCCCC2CCCC2)C(=O)O.COC1=CC=CC=C1OC(=O)N

InChI

InChI=1S/C20H30O4.C8H9NO3/c1-2-23-19(20(21)22)15-17-10-12-18(13-11-17)24-14-6-5-9-16-7-3-4-8-16;1-11-6-4-2-3-5-7(6)12-8(9)10/h10-13,16,19H,2-9,14-15H2,1H3,(H,21,22);2-5H,1H3,(H2,9,10)