2-[4-[2-azanyl-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-oxidanylidene-ethyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-azanyl-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-oxidanylidene-ethyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[2-amino-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-oxo-ethyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[2-amino-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-oxoethyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[2-amino-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-oxoethyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[2-amino-1-[3-(4-tert-butylcyclohexyl)phenyl]-2-keto-ethyl]-2-methoxy-phenoxy]acetic acid Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C2=CC(=CC=C2)C(C3=CC(=C(C=C3)OCC(=O)O)OC)C(=O)N

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=CC(=CC=C2)C(C3=CC(=C(C=C3)OCC(=O)O)OC)C(=O)N

InChI

InChI=1S/C27H35NO5/c1-27(2,3)21-11-8-17(9-12-21)18-6-5-7-19(14-18)25(26(28)31)20-10-13-22(23(15-20)32-4)33-16-24(29)30/h5-7,10,13-15,17,21,25H,8-9,11-12,16H2,1-4H3,(H2,28,31)(H,29,30)