3-(1,3-benzodioxol-5-yl)-5-thiophen-3-yl-4-(3,4,5-trimethoxyphenyl)-1,2-oxazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-thiophen-3-yl-4-(3,4,5-trimethoxyphenyl)-1,2-oxazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-(3-thienyl)-4-(3,4,5-trimethoxyphenyl)isoxazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-(3-thiophenyl)-4-(3,4,5-trimethoxyphenyl)isoxazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-thiophen-3-yl-4-(3,4,5-trimethoxyphenyl)-1,2-oxazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(3-thienyl)-4-(3,4,5-trimethoxyphenyl)isoxazole Formula: C23H19NO6S MolecularWeight: 437.46506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(ON=C2C3=CC4=C(C=C3)OCO4)C5=CSC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(ON=C2C3=CC4=C(C=C3)OCO4)C5=CSC=C5

InChI

InChI=1S/C23H19NO6S/c1-25-18-9-15(10-19(26-2)23(18)27-3)20-21(24-30-22(20)14-6-7-31-11-14)13-4-5-16-17(8-13)29-12-28-16/h4-11H,12H2,1-3H3