3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-(4-methoxyphenyl)sulfonyl-indole

Systemtic Name: 3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-(4-methoxyphenyl)sulfonyl-indole Openeye Name: 3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-(4-methoxyphenyl)sulfonyl-indole CAS Name: 3-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-1-(4-methoxyphenyl)sulfonylindole IUPAC Name: 3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1-(4-methoxyphenyl)sulfonylindole Traditional Name: 3-[[4-(2-methoxyphenyl)piperazino]methyl]-1-(4-methoxyphenyl)sulfonyl-indole Formula: C27H29N3O4S MolecularWeight: 491.60186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CN4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CN4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C27H29N3O4S/c1-33-22-11-13-23(14-12-22)35(31,32)30-20-21(24-7-3-4-8-25(24)30)19-28-15-17-29(18-16-28)26-9-5-6-10-27(26)34-2/h3-14,20H,15-19H2,1-2H3