ethyl 2,4-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(isovalerylamino)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C15H23N3O4 MolecularWeight: 309.36082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NNC(=O)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NNC(=O)CC(C)C)C

InChI

InChI=1S/C15H23N3O4/c1-6-22-15(21)12-9(4)13(16-10(12)5)14(20)18-17-11(19)7-8(2)3/h8,16H,6-7H2,1-5H3,(H,17,19)(H,18,20)