[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-[(4-fluorophenyl)methoxy]benzoate CAS Name: 3-[(4-fluorophenyl)methoxy]benzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate Traditional Name: 3-(4-fluorobenzyl)oxybenzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C20H21FN2O5 MolecularWeight: 388.389543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C20H21FN2O5/c1-12(2)17(18(24)23-20(22)26)28-19(25)14-4-3-5-16(10-14)27-11-13-6-8-15(21)9-7-13/h3-10,12,17H,11H2,1-2H3,(H3,22,23,24,26)