bis[3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] benzene-1,3-dicarboxylate

Systemtic Name: bis[3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] benzene-1,3-dicarboxylate Openeye Name: bis[3-[2-(tritylamino)ethyl]-1H-indol-5-yl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] ester IUPAC Name: bis[3-[2-(tritylamino)ethyl]-1H-indol-5-yl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis[3-[2-(tritylamino)ethyl]-1H-indol-5-yl] ester Formula: C66H54N4O4 MolecularWeight: 967.15936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NCCC4=CNC5=C4C=C(C=C5)OC(=O)C6=CC(=CC=C6)C(=O)OC7=CC8=C(C=C7)NC=C8CCNC(C9=CC=CC=C9)(C1=CC=CC=C1)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NCCC4=CNC5=C4C=C(C=C5)OC(=O)C6=CC(=CC=C6)C(=O)OC7=CC8=C(C=C7)NC=C8CCNC(C9=CC=CC=C9)(C1=CC=CC=C1)C1=CC=CC=C1

InChI

InChI=1S/C66H54N4O4/c71-63(73-57-34-36-61-59(43-57)49(45-67-61)38-40-69-65(51-22-7-1-8-23-51,52-24-9-2-10-25-52)53-26-11-3-12-27-53)47-20-19-21-48(42-47)64(72)74-58-35-37-62-60(44-58)50(46-68-62)39-41-70-66(54-28-13-4-14-29-54,55-30-15-5-16-31-55)56-32-17-6-18-33-56/h1-37,42-46,67-70H,38-41H2