S-[1-[5,8-dimethoxy-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-methyl-pent-3-enyl] 2-methylpropanethioate

Systemtic Name: S-[1-[5,8-dimethoxy-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-methyl-pent-3-enyl] 2-methylpropanethioate Openeye Name: S-[1-(5,8-dimethoxy-1,4-dioxo-2-naphthyl)-4-methyl-pent-3-enyl] 2-methylpropanethioate CAS Name: 2-methylpropanethioic acid S-[1-(5,8-dimethoxy-1,4-dioxo-2-naphthalenyl)-4-methylpent-3-enyl] ester IUPAC Name: S-[1-(5,8-dimethoxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 2-methylpropanethioate Traditional Name: 2-methylpropanethioic acid S-[1-(1,4-diketo-5,8-dimethoxy-2-naphthyl)-4-methyl-pent-3-enyl] ester Formula: C22H26O5S MolecularWeight: 402.50384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)OC)OC

Isomeric SMILES

CC(C)C(=O)SC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)OC)OC

InChI

InChI=1S/C22H26O5S/c1-12(2)7-10-18(28-22(25)13(3)4)14-11-15(23)19-16(26-5)8-9-17(27-6)20(19)21(14)24/h7-9,11,13,18H,10H2,1-6H3