methyl 2-[2-(aminocarbonylamino)propanoylamino]-5-methyl-benzoate

Systemtic Name: methyl 2-[2-(aminocarbonylamino)propanoylamino]-5-methyl-benzoate Openeye Name: methyl 5-methyl-2-(2-ureidopropanoylamino)benzoate CAS Name: 2-[[2-(carbamoylamino)-1-oxopropyl]amino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-(carbamoylamino)propanoylamino]-5-methylbenzoate Traditional Name: 5-methyl-2-(2-ureidopropanoylamino)benzoic acid methyl ester Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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