[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-azanyl-4-chloranyl-benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C13H16ClN3O4 MolecularWeight: 313.73684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3O4/c1-6(2)10(11(18)17-13(16)20)21-12(19)7-3-4-8(14)9(15)5-7/h3-6,10H,15H2,1-2H3,(H3,16,17,18,20)