(3E)-3-[(2-methoxyphenyl)-phenyl-methylidene]-1,3a,4,6a-tetrahydropentalen-2-one

Systemtic Name: (3E)-3-[(2-methoxyphenyl)-phenyl-methylidene]-1,3a,4,6a-tetrahydropentalen-2-one Openeye Name: (3E)-3-[(2-methoxyphenyl)-phenyl-methylene]-1,3a,4,6a-tetrahydropentalen-2-one CAS Name: (3E)-3-[(2-methoxyphenyl)-phenylmethylidene]-1,3a,4,6a-tetrahydropentalen-2-one IUPAC Name: (3E)-3-[(2-methoxyphenyl)-phenylmethylidene]-1,3a,4,6a-tetrahydropentalen-2-one Traditional Name: (3E)-3-[(2-methoxyphenyl)-phenyl-methylene]-1,3a,4,6a-tetrahydropentalen-2-one Formula: C22H20O2 MolecularWeight: 316.393

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=C2C3CC=CC3CC2=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1/C(=C/2\C3CC=CC3CC2=O)/C4=CC=CC=C4

InChI

InChI=1S/C22H20O2/c1-24-20-13-6-5-11-18(20)21(15-8-3-2-4-9-15)22-17-12-7-10-16(17)14-19(22)23/h2-11,13,16-17H,12,14H2,1H3/b22-21+