methyl 3-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]benzoate

Systemtic Name: methyl 3-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]benzoate Openeye Name: methyl 3-[(3-methyl-2-ureido-butanoyl)amino]benzoate CAS Name: 3-[[2-(carbamoylamino)-3-methyl-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(carbamoylamino)-3-methylbutanoyl]amino]benzoate Traditional Name: 3-[(3-methyl-2-ureido-butanoyl)amino]benzoic acid methyl ester Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)OC)NC(=O)N

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)OC)NC(=O)N

InChI

InChI=1S/C14H19N3O4/c1-8(2)11(17-14(15)20)12(18)16-10-6-4-5-9(7-10)13(19)21-3/h4-8,11H,1-3H3,(H,16,18)(H3,15,17,20)