2-methyl-1-(4-methyl-5-tridecyl-thiophen-2-yl)dodecan-1-one

Systemtic Name: 2-methyl-1-(4-methyl-5-tridecyl-thiophen-2-yl)dodecan-1-one Openeye Name: 2-methyl-1-(4-methyl-5-tridecyl-2-thienyl)dodecan-1-one CAS Name: 2-methyl-1-(4-methyl-5-tridecyl-2-thiophenyl)-1-dodecanone IUPAC Name: 2-methyl-1-(4-methyl-5-tridecylthiophen-2-yl)dodecan-1-one Traditional Name: 2-methyl-1-(4-methyl-5-tridecyl-2-thienyl)dodecan-1-one Formula: C31H56OS MolecularWeight: 476.84074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=C(C=C(S1)C(=O)C(C)CCCCCCCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCC1=C(C=C(S1)C(=O)C(C)CCCCCCCCCC)C

InChI

InChI=1S/C31H56OS/c1-5-7-9-11-13-15-16-17-19-21-23-25-29-28(4)26-30(33-29)31(32)27(3)24-22-20-18-14-12-10-8-6-2/h26-27H,5-25H2,1-4H3