3-butoxy-4-(3-oxidanylpropylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-butoxy-4-(3-oxidanylpropylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-butoxy-4-(3-hydroxypropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-butoxy-4-(3-hydroxypropylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-butoxy-4-(3-hydroxypropylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-butoxy-4-(3-hydroxypropylamino)cyclobut-3-ene-1,2-quinone Formula: C11H17NO4 MolecularWeight: 227.25698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)C1=O)NCCCO

Isomeric SMILES

CCCCOC1=C(C(=O)C1=O)NCCCO

InChI

InChI=1S/C11H17NO4/c1-2-3-7-16-11-8(9(14)10(11)15)12-5-4-6-13/h12-13H,2-7H2,1H3