3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-oxidanylidene-ethoxy]phenyl]-2-methoxy-propanoic acid

Systemtic Name: 3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-oxidanylidene-ethoxy]phenyl]-2-methoxy-propanoic acid Openeye Name: 3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-oxo-ethoxy]phenyl]-2-methoxy-propanoic acid CAS Name: 3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-oxoethoxy]phenyl]-2-methoxypropanoic acid IUPAC Name: 3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-oxoethoxy]phenyl]-2-methoxypropanoic acid Traditional Name: 3-[4-[2-[(4-tert-butylcyclohexyl)amino]-2-keto-ethoxy]phenyl]-2-methoxy-propionic acid Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)NC(=O)COC2=CC=C(C=C2)CC(C(=O)O)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)NC(=O)COC2=CC=C(C=C2)CC(C(=O)O)OC

InChI

InChI=1S/C22H33NO5/c1-22(2,3)16-7-9-17(10-8-16)23-20(24)14-28-18-11-5-15(6-12-18)13-19(27-4)21(25)26/h5-6,11-12,16-17,19H,7-10,13-14H2,1-4H3,(H,23,24)(H,25,26)