methyl N-[2-(aminocarbonylamino)-2-chloranyl-propanoyl]-N-(2,6-dimethylphenyl)carbamate

Systemtic Name: methyl N-[2-(aminocarbonylamino)-2-chloranyl-propanoyl]-N-(2,6-dimethylphenyl)carbamate Openeye Name: methyl N-(2-chloro-2-ureido-propanoyl)-N-(2,6-dimethylphenyl)carbamate CAS Name: N-[2-(carbamoylamino)-2-chloro-1-oxopropyl]-N-(2,6-dimethylphenyl)carbamic acid methyl ester IUPAC Name: methyl N-[2-(carbamoylamino)-2-chloropropanoyl]-N-(2,6-dimethylphenyl)carbamate Traditional Name: N-(2-chloro-2-ureido-propanoyl)-N-(2,6-dimethylphenyl)carbamic acid methyl ester Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClN3O4/c1-8-6-5-7-9(2)10(8)18(13(21)22-4)11(19)14(3,15)17-12(16)20/h5-7H,1-4H3,(H3,16,17,20)