[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybutanoate

Systemtic Name: [1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybutanoate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-1-methyl-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [2-(2-ethyl-6-methyl-anilino)-2-keto-1-methyl-ethyl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C)OC(=O)CCCOC2=CC=CC=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C)OC(=O)CCCOC2=CC=CC=C2)C

InChI

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