2-[2-[2-oxidanylidene-4-[(triphenylmethyl)amino]pyrimidin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-oxidanylidene-4-[(triphenylmethyl)amino]pyrimidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-oxo-4-(tritylamino)pyrimidin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-oxo-4-[(triphenylmethyl)amino]-1-pyrimidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-oxo-4-(tritylamino)pyrimidin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-keto-4-(tritylamino)pyrimidin-1-yl]ethyl]isoindoline-1,3-quinone Formula: C33H26N4O3 MolecularWeight: 526.58454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC(=O)N(C=C4)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC(=O)N(C=C4)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C33H26N4O3/c38-30-27-18-10-11-19-28(27)31(39)37(30)23-22-36-21-20-29(34-32(36)40)35-33(24-12-4-1-5-13-24,25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-21H,22-23H2,(H,34,35,40)