[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate CAS Name: 3-ethoxy-4-(2-phenoxyethoxy)benzoic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-phenoxyethoxy)benzoic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H31NO6 MolecularWeight: 429.50604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC(C)C)OCCOC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC(C)C)OCCOC2=CC=CC=C2

InChI

InChI=1S/C24H31NO6/c1-5-28-22-15-19(24(27)31-18(4)23(26)25-16-17(2)3)11-12-21(22)30-14-13-29-20-9-7-6-8-10-20/h6-12,15,17-18H,5,13-14,16H2,1-4H3,(H,25,26)