methyl 4-[[2-(aminocarbonylamino)propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(aminocarbonylamino)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[(2-ureidopropanoylamino)methyl]benzoate CAS Name: 4-[[[2-(carbamoylamino)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(carbamoylamino)propanoylamino]methyl]benzoate Traditional Name: 4-[(2-ureidopropanoylamino)methyl]benzoic acid methyl ester Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)C(=O)OC)NC(=O)N

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)C(=O)OC)NC(=O)N

InChI

InChI=1S/C13H17N3O4/c1-8(16-13(14)19)11(17)15-7-9-3-5-10(6-4-9)12(18)20-2/h3-6,8H,7H2,1-2H3,(H,15,17)(H3,14,16,19)