5-[(2-chloranylethanoylamino)carbamoyl]-2-ethyl-3-(hydroxymethyl)benzamide

Systemtic Name: 5-[(2-chloranylethanoylamino)carbamoyl]-2-ethyl-3-(hydroxymethyl)benzamide Openeye Name: 5-[[(2-chloroacetyl)amino]carbamoyl]-2-ethyl-3-(hydroxymethyl)benzamide CAS Name: 5-[[(2-chloro-1-oxoethyl)hydrazo]-oxomethyl]-2-ethyl-3-(hydroxymethyl)benzamide IUPAC Name: 5-[[(2-chloroacetyl)amino]carbamoyl]-2-ethyl-3-(hydroxymethyl)benzamide Traditional Name: 5-[[(2-chloroacetyl)amino]carbamoyl]-2-ethyl-3-methylol-benzamide Formula: C13H16ClN3O4 MolecularWeight: 313.73684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1CO)C(=O)NNC(=O)CCl)C(=O)N

Isomeric SMILES

CCC1=C(C=C(C=C1CO)C(=O)NNC(=O)CCl)C(=O)N

InChI

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