methyl (2E)-8-methoxy-2-[(4-methoxyphenyl)methylidene]oct-3-ynoate

Systemtic Name: methyl (2E)-8-methoxy-2-[(4-methoxyphenyl)methylidene]oct-3-ynoate Openeye Name: methyl (2E)-8-methoxy-2-[(4-methoxyphenyl)methylene]oct-3-ynoate CAS Name: (2E)-8-methoxy-2-[(4-methoxyphenyl)methylidene]-3-octynoic acid methyl ester IUPAC Name: methyl (2E)-8-methoxy-2-[(4-methoxyphenyl)methylidene]oct-3-ynoate Traditional Name: (2E)-8-methoxy-2-p-anisylidene-oct-3-ynoic acid methyl ester Formula: C18H22O4 MolecularWeight: 302.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCCC#CC(=CC1=CC=C(C=C1)OC)C(=O)OC

Isomeric SMILES

COCCCCC#C/C(=C\C1=CC=C(C=C1)OC)/C(=O)OC

InChI

InChI=1S/C18H22O4/c1-20-13-7-5-4-6-8-16(18(19)22-3)14-15-9-11-17(21-2)12-10-15/h9-12,14H,4-5,7,13H2,1-3H3/b16-14+