ethyl 4-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]benzoate Openeye Name: ethyl 4-[(3-methyl-2-ureido-butanoyl)amino]benzoate CAS Name: 4-[[2-(carbamoylamino)-3-methyl-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(carbamoylamino)-3-methylbutanoyl]amino]benzoate Traditional Name: 4-[(3-methyl-2-ureido-butanoyl)amino]benzoic acid ethyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O4/c1-4-22-14(20)10-5-7-11(8-6-10)17-13(19)12(9(2)3)18-15(16)21/h5-9,12H,4H2,1-3H3,(H,17,19)(H3,16,18,21)