(2E,6S)-2-[(3,4-dimethoxyphenyl)methylidene]-6-phenyl-cyclohexan-1-one

Systemtic Name: (2E,6S)-2-[(3,4-dimethoxyphenyl)methylidene]-6-phenyl-cyclohexan-1-one Openeye Name: (2E,6S)-2-[(3,4-dimethoxyphenyl)methylene]-6-phenyl-cyclohexanone CAS Name: (2E,6S)-2-[(3,4-dimethoxyphenyl)methylidene]-6-phenyl-1-cyclohexanone IUPAC Name: (2E,6S)-2-[(3,4-dimethoxyphenyl)methylidene]-6-phenylcyclohexan-1-one Traditional Name: (2S,6E)-2-phenyl-6-veratrylidene-cyclohexanone Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2CCCC(C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\CCC[C@H](C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H22O3/c1-23-19-12-11-15(14-20(19)24-2)13-17-9-6-10-18(21(17)22)16-7-4-3-5-8-16/h3-5,7-8,11-14,18H,6,9-10H2,1-2H3/b17-13+/t18-/m0/s1