4-[2-[[3-(4-tert-butylcyclohexyl)phenyl]amino]-1-methoxy-2-oxidanylidene-ethyl]-2-methoxy-benzoic acid

Systemtic Name: 4-[2-[[3-(4-tert-butylcyclohexyl)phenyl]amino]-1-methoxy-2-oxidanylidene-ethyl]-2-methoxy-benzoic acid Openeye Name: 4-[2-[3-(4-tert-butylcyclohexyl)anilino]-1-methoxy-2-oxo-ethyl]-2-methoxy-benzoic acid CAS Name: 4-[2-[3-(4-tert-butylcyclohexyl)anilino]-1-methoxy-2-oxoethyl]-2-methoxybenzoic acid IUPAC Name: 4-[2-[3-(4-tert-butylcyclohexyl)anilino]-1-methoxy-2-oxoethyl]-2-methoxybenzoic acid Traditional Name: 4-[2-[3-(4-tert-butylcyclohexyl)anilino]-2-keto-1-methoxy-ethyl]-2-methoxy-benzoic 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)NC(=O)C(C3=CC(=C(C=C3)C(=O)O)OC)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=CC(=CC=C2)NC(=O)C(C3=CC(=C(C=C3)C(=O)O)OC)OC

InChI

InChI=1S/C27H35NO5/c1-27(2,3)20-12-9-17(10-13-20)18-7-6-8-21(15-18)28-25(29)24(33-5)19-11-14-22(26(30)31)23(16-19)32-4/h6-8,11,14-17,20,24H,9-10,12-13H2,1-5H3,(H,28,29)(H,30,31)