2-[4,6,7-trimethoxy-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethanamine

Systemtic Name: 2-[4,6,7-trimethoxy-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethanamine Openeye Name: 2-[4,6,7-trimethoxy-1-(p-tolylsulfonyl)indol-3-yl]ethanamine CAS Name: 2-[4,6,7-trimethoxy-1-(4-methylphenyl)sulfonyl-3-indolyl]ethanamine IUPAC Name: 2-[4,6,7-trimethoxy-1-(4-methylphenyl)sulfonylindol-3-yl]ethanamine Traditional Name: 2-(4,6,7-trimethoxy-1-tosyl-indol-3-yl)ethylamine Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=C(C=C3OC)OC)OC)CCN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=C(C=C3OC)OC)OC)CCN

InChI

InChI=1S/C20H24N2O5S/c1-13-5-7-15(8-6-13)28(23,24)22-12-14(9-10-21)18-16(25-2)11-17(26-3)20(27-4)19(18)22/h5-8,11-12H,9-10,21H2,1-4H3