[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-cyclopropyl-2,5-dimethyl-3-pyrrolecarboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C16H23N3O4 MolecularWeight: 321.37152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C16H23N3O4/c1-8(2)13(14(20)18-16(17)22)23-15(21)12-7-9(3)19(10(12)4)11-5-6-11/h7-8,11,13H,5-6H2,1-4H3,(H3,17,18,20,22)