3,4,5-triheptyl-6-pentoxy-benzene-1,2-diolate

Systemtic Name: 3,4,5-triheptyl-6-pentoxy-benzene-1,2-diolate Openeye Name: 3,4,5-triheptyl-6-pentoxy-benzene-1,2-diolate CAS Name: 3,4,5-triheptyl-6-pentoxybenzene-1,2-diolate IUPAC Name: 3,4,5-triheptyl-6-pentoxybenzene-1,2-diolate Traditional Name: 3-amoxy-4,5,6-triheptyl-benzene-1,2-diolate Formula: C32H56O3-2 MolecularWeight: 488.78524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C(=C1CCCCCCC)OCCCCC)[O-])[O-])CCCCCCC

Isomeric SMILES

CCCCCCCC1=C(C(=C(C(=C1CCCCCCC)OCCCCC)[O-])[O-])CCCCCCC

InChI

InChI=1S/C32H58O3/c1-5-9-13-16-19-23-27-28(24-20-17-14-10-6-2)30(33)31(34)32(35-26-22-12-8-4)29(27)25-21-18-15-11-7-3/h33-34H,5-26H2,1-4H3/p-2