2-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-4-[4-[(3-methylphenyl)-phenyl-amino]phenyl]hexanoic acid

Systemtic Name: 2-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-4-[4-[(3-methylphenyl)-phenyl-amino]phenyl]hexanoic acid Openeye Name: 2-(2-methoxy-2-oxo-ethyl)-2-methyl-4-[4-[N-(m-tolyl)anilino]phenyl]hexanoic acid CAS Name: 2-(2-methoxy-2-oxoethyl)-2-methyl-4-[4-(N-(3-methylphenyl)anilino)phenyl]hexanoic acid IUPAC Name: 2-(2-methoxy-2-oxoethyl)-2-methyl-4-[4-(N-(3-methylphenyl)anilino)phenyl]hexanoic acid Traditional Name: 2-(2-keto-2-methoxy-ethyl)-2-methyl-4-[4-[N-(m-tolyl)anilino]phenyl]hexanoic acid Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(CC(=O)OC)C(=O)O)C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCC(CC(C)(CC(=O)OC)C(=O)O)C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C29H33NO4/c1-5-22(19-29(3,28(32)33)20-27(31)34-4)23-14-16-25(17-15-23)30(24-11-7-6-8-12-24)26-13-9-10-21(2)18-26/h6-18,22H,5,19-20H2,1-4H3,(H,32,33)