3-(1-oxidanylheptyl)-4-pentyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(1-oxidanylheptyl)-4-pentyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-(1-hydroxyheptyl)-4-pentyl-cyclobut-3-ene-1,2-dione CAS Name: 3-(1-hydroxyheptyl)-4-pentylcyclobut-3-ene-1,2-dione IUPAC Name: 3-(1-hydroxyheptyl)-4-pentylcyclobut-3-ene-1,2-dione Traditional Name: 3-amyl-4-(1-hydroxyheptyl)cyclobut-3-ene-1,2-quinone Formula: C16H26O3 MolecularWeight: 266.37584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=C(C(=O)C1=O)CCCCC)O

Isomeric SMILES

CCCCCCC(C1=C(C(=O)C1=O)CCCCC)O

InChI

InChI=1S/C16H26O3/c1-3-5-7-9-11-13(17)14-12(10-8-6-4-2)15(18)16(14)19/h13,17H,3-11H2,1-2H3