5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thiophenyl)ethynyl]indole IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,5-dimethoxyphenyl)-1-methyl-3-[2-(3-thienyl)ethynyl]indole Formula: C31H25NO4S MolecularWeight: 507.5995

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=CC4=C(C=C3)OCCO4)C(=C1C5=CC(=CC(=C5)OC)OC)C#CC6=CSC=C6

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=CC4=C(C=C3)OCCO4)C(=C1C5=CC(=CC(=C5)OC)OC)C#CC6=CSC=C6

InChI

InChI=1S/C31H25NO4S/c1-32-28-8-5-21(22-6-9-29-30(17-22)36-12-11-35-29)16-27(28)26(7-4-20-10-13-37-19-20)31(32)23-14-24(33-2)18-25(15-23)34-3/h5-6,8-10,13-19H,11-12H2,1-3H3