3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]benzene-1,2-diol

Systemtic Name: 3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]benzene-1,2-diol Openeye Name: 3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]benzene-1,2-diol CAS Name: 3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]benzene-1,2-diol IUPAC Name: 3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]benzene-1,2-diol Traditional Name: 3-[bis[6-(diethylamino)-1H-indol-3-yl]methyl]pyrocatechol Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=CN2)C(C3=C(C(=CC=C3)O)O)C4=CNC5=C4C=CC(=C5)N(CC)CC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=CN2)C(C3=C(C(=CC=C3)O)O)C4=CNC5=C4C=CC(=C5)N(CC)CC

InChI

InChI=1S/C31H36N4O2/c1-5-34(6-2)20-12-14-22-25(18-32-27(22)16-20)30(24-10-9-11-29(36)31(24)37)26-19-33-28-17-21(13-15-23(26)28)35(7-3)8-4/h9-19,30,32-33,36-37H,5-8H2,1-4H3