(phenylmethyl) 2-(aminocarbonylcarbamoyl)-2-ethyl-butanoate

Systemtic Name: (phenylmethyl) 2-(aminocarbonylcarbamoyl)-2-ethyl-butanoate Openeye Name: benzyl 2-allophanoyl-2-ethyl-butanoate CAS Name: 2-[(carbamoylamino)-oxomethyl]-2-ethylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(carbamoylcarbamoyl)-2-ethylbutanoate Traditional Name: 2-allophanoyl-2-ethyl-butyric acid benzyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)NC(=O)N)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(CC)(C(=O)NC(=O)N)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4/c1-3-15(4-2,12(18)17-14(16)20)13(19)21-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H3,16,17,18,20)