(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-decoxyphenyl)-1,3-oxazol-5-one

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-decoxyphenyl)-1,3-oxazol-5-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2-(4-decoxyphenyl)oxazol-5-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-decoxyphenyl)-5-oxazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-decoxyphenyl)-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-decoxyphenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C27H31NO5 MolecularWeight: 449.53874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=NC(=CC3=CC4=C(C=C3)OCO4)C(=O)O2

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=N/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)O2

InChI

InChI=1S/C27H31NO5/c1-2-3-4-5-6-7-8-9-16-30-22-13-11-21(12-14-22)26-28-23(27(29)33-26)17-20-10-15-24-25(18-20)32-19-31-24/h10-15,17-18H,2-9,16,19H2,1H3/b23-17-