(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-7-heptadecan-4-yl-1-benzothiophen-3-one

Systemtic Name: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-7-heptadecan-4-yl-1-benzothiophen-3-one Openeye Name: (2Z)-2-[(3,4-dimethoxyphenyl)methylene]-7-(1-propyltetradecyl)benzothiophen-3-one CAS Name: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-7-heptadecan-4-yl-1-benzothiophen-3-one IUPAC Name: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-7-heptadecan-4-yl-1-benzothiophen-3-one Traditional Name: (2Z)-7-(1-propyltetradecyl)-2-veratrylidene-benzothiophen-3-one Formula: C34H48O3S MolecularWeight: 536.80812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCC)C1=CC=CC2=C1SC(=CC3=CC(=C(C=C3)OC)OC)C2=O

Isomeric SMILES

CCCCCCCCCCCCCC(CCC)C1=CC=CC2=C1S/C(=C\C3=CC(=C(C=C3)OC)OC)/C2=O

InChI

InChI=1S/C34H48O3S/c1-5-7-8-9-10-11-12-13-14-15-16-19-27(18-6-2)28-20-17-21-29-33(35)32(38-34(28)29)25-26-22-23-30(36-3)31(24-26)37-4/h17,20-25,27H,5-16,18-19H2,1-4H3/b32-25-