4-[2-(aminocarbonylamino)propanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-(aminocarbonylamino)propanoylamino]-3-methyl-benzoic acid Openeye Name: 3-methyl-4-(2-ureidopropanoylamino)benzoic acid CAS Name: 4-[[2-(carbamoylamino)-1-oxopropyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[2-(carbamoylamino)propanoylamino]-3-methylbenzoic acid Traditional Name: 3-methyl-4-(2-ureidopropanoylamino)benzoic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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