2-[2-(aminocarbonylamino)propanoylamino]-5-methyl-benzoic acid

Systemtic Name: 2-[2-(aminocarbonylamino)propanoylamino]-5-methyl-benzoic acid Openeye Name: 5-methyl-2-(2-ureidopropanoylamino)benzoic acid CAS Name: 2-[[2-(carbamoylamino)-1-oxopropyl]amino]-5-methylbenzoic acid IUPAC Name: 2-[2-(carbamoylamino)propanoylamino]-5-methylbenzoic acid Traditional Name: 5-methyl-2-(2-ureidopropanoylamino)benzoic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O4/c1-6-3-4-9(8(5-6)11(17)18)15-10(16)7(2)14-12(13)19/h3-5,7H,1-2H3,(H,15,16)(H,17,18)(H3,13,14,19)