(2E,6S)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-6-methyl-cyclohexan-1-one

Systemtic Name: (2E,6S)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-6-methyl-cyclohexan-1-one Openeye Name: (2E,6S)-2-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methylene]-6-methyl-cyclohexanone CAS Name: (2E,6S)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-6-methyl-1-cyclohexanone IUPAC Name: (2E,6S)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-6-methylcyclohexan-1-one Traditional Name: (2E,6S)-2-[3-methoxy-4-(2-thenyloxy)benzylidene]-6-methyl-cyclohexanone Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=CC2=CC(=C(C=C2)OCC3=CC=CS3)OC)C1=O

Isomeric SMILES

C[C@H]1CCC/C(=C\C2=CC(=C(C=C2)OCC3=CC=CS3)OC)/C1=O

InChI

InChI=1S/C20H22O3S/c1-14-5-3-6-16(20(14)21)11-15-8-9-18(19(12-15)22-2)23-13-17-7-4-10-24-17/h4,7-12,14H,3,5-6,13H2,1-2H3/b16-11+/t14-/m0/s1