methyl 2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate

Systemtic Name: methyl 2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate Openeye Name: methyl 2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]benzoate CAS Name: 2-[[4-(3-methyl-4-propan-2-ylphenoxy)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(3-methyl-4-propan-2-ylphenoxy)butanoylamino]benzoate Traditional Name: 2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]benzoic acid methyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)NC2=CC=CC=C2C(=O)OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)NC2=CC=CC=C2C(=O)OC)C(C)C

InChI

InChI=1S/C22H27NO4/c1-15(2)18-12-11-17(14-16(18)3)27-13-7-10-21(24)23-20-9-6-5-8-19(20)22(25)26-4/h5-6,8-9,11-12,14-15H,7,10,13H2,1-4H3,(H,23,24)