[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-methylbenzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-methylbenzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C14H18N2O4 MolecularWeight: 278.30372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C14H18N2O4/c1-8(2)11(12(17)16-14(15)19)20-13(18)10-6-4-9(3)5-7-10/h4-8,11H,1-3H3,(H3,15,16,17,19)