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5-acetamido-2-(propan-2-ylcarbamoylamino)benzoate

5-acetamido-2-(propan-2-ylcarbamoylamino)benzoate

Systemtic Name:5-acetamido-2-(propan-2-ylcarbamoylamino)benzoate
Openeye Name:5-acetamido-2-(isopropylcarbamoylamino)benzoate
CAS Name:5-acetamido-2-[[oxo-(propan-2-ylamino)methyl]amino]benzoate
IUPAC Name:5-acetamido-2-(propan-2-ylcarbamoylamino)benzoate
Traditional Name:5-acetamido-2-(isopropylcarbamoylamino)benzoate
Formula: C13H16N3O4-
MolecularWeight: 278.28384
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=C(C=C(C=C1)NC(=O)C)C(=O)[O-]


Isomeric SMILES

CC(C)NC(=O)NC1=C(C=C(C=C1)NC(=O)C)C(=O)[O-]


InChI

InChI=1S/C13H17N3O4/c1-7(2)14-13(20)16-11-5-4-9(15-8(3)17)6-10(11)12(18)19/h4-7H,1-3H3,(H,15,17)(H,18,19)(H2,14,16,20)/p-1


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