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

Systemtic Name: S-[1-[5,8-dimethoxy-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-methyl-pent-3-enyl] (E)-but-2-enethioate Openeye Name: S-[1-(5,8-dimethoxy-1,4-dioxo-2-naphthyl)-4-methyl-pent-3-enyl] (E)-but-2-enethioate CAS Name: (E)-2-butenethioic 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] (E)-but-2-enethioate Traditional Name: (E)-but-2-enethioic acid S-[1-(1,4-diketo-5,8-dimethoxy-2-naphthyl)-4-methyl-pent-3-enyl] ester Formula: C22H24O5S MolecularWeight: 400.48796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24O5S/c1-6-7-19(24)28-18(11-8-13(2)3)14-12-15(23)20-16(26-4)9-10-17(27-5)21(20)22(14)25/h6-10,12,18H,11H2,1-5H3/b7-6+