3-[4-(5-butoxypentoxy)phenyl]-2-propan-2-yloxy-propanoic acid; ethyl carbamate

Systemtic Name: 3-[4-(5-butoxypentoxy)phenyl]-2-propan-2-yloxy-propanoic acid; ethyl carbamate Openeye Name: 3-[4-(5-butoxypentoxy)phenyl]-2-isopropoxy-propanoic acid; ethyl carbamate CAS Name: 3-[4-(5-butoxypentoxy)phenyl]-2-propan-2-yloxypropanoic acid; carbamic acid ethyl ester IUPAC Name: 3-[4-(5-butoxypentoxy)phenyl]-2-propan-2-yloxypropanoic acid; ethyl carbamate Traditional Name: 3-[4-(5-butoxypentoxy)phenyl]-2-isopropoxy-propionic acid; urethan Formula: C24H41NO7 MolecularWeight: 455.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCCCOC1=CC=C(C=C1)CC(C(=O)O)OC(C)C.CCOC(=O)N

Isomeric SMILES

CCCCOCCCCCOC1=CC=C(C=C1)CC(C(=O)O)OC(C)C.CCOC(=O)N

InChI

InChI=1S/C21H34O5.C3H7NO2/c1-4-5-13-24-14-7-6-8-15-25-19-11-9-18(10-12-19)16-20(21(22)23)26-17(2)3;1-2-6-3(4)5/h9-12,17,20H,4-8,13-16H2,1-3H3,(H,22,23);2H2,1H3,(H2,4,5)