5-[bis(2-hydroxyethyl)amino]-1,3-bis(triphenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 5-[bis(2-hydroxyethyl)amino]-1,3-bis(triphenylmethyl)pyrimidine-2,4-dione Openeye Name: 5-[bis(2-hydroxyethyl)amino]-1,3-ditrityl-pyrimidine-2,4-dione CAS Name: 5-[bis(2-hydroxyethyl)amino]-1,3-bis(triphenylmethyl)pyrimidine-2,4-dione IUPAC Name: 5-[bis(2-hydroxyethyl)amino]-1,3-ditritylpyrimidine-2,4-dione Traditional Name: 5-[bis(2-hydroxyethyl)amino]-1,3-ditrityl-pyrimidine-2,4-quinone Formula: C46H41N3O4 MolecularWeight: 699.83544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(C(=O)N(C4=O)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)N(CCO)CCO

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(C(=O)N(C4=O)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)N(CCO)CCO

InChI

InChI=1S/C46H41N3O4/c50-33-31-47(32-34-51)42-35-48(45(36-19-7-1-8-20-36,37-21-9-2-10-22-37)38-23-11-3-12-24-38)44(53)49(43(42)52)46(39-25-13-4-14-26-39,40-27-15-5-16-28-40)41-29-17-6-18-30-41/h1-30,35,50-51H,31-34H2