2-(1-hexadecoxy-4-methyl-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 2-(1-hexadecoxy-4-methyl-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 2-(1-hexadecoxy-4-methyl-pent-3-enyl)-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 2-(1-hexadecoxy-4-methylpent-3-enyl)-5,8-dihydroxynaphthalene-1,4-dione IUPAC Name: 2-(1-hexadecoxy-4-methylpent-3-enyl)-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 2-(1-cetyloxy-4-methyl-pent-3-enyl)-5,8-dihydroxy-1,4-naphthoquinone Formula: C32H48O5 MolecularWeight: 512.72052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

InChI

InChI=1S/C32H48O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-37-29(21-18-24(2)3)25-23-28(35)30-26(33)19-20-27(34)31(30)32(25)36/h18-20,23,29,33-34H,4-17,21-22H2,1-3H3