2-azanylidene-5-[(2-azanylidene-4-oxidanyl-6-oxidanylidene-1,3-diphenyl-pyrimidin-5-yl)-(1,3-benzodioxol-5-yl)methyl]-6-oxidanyl-1,3-diphenyl-pyrimidin-4-one

Systemtic Name: 2-azanylidene-5-[(2-azanylidene-4-oxidanyl-6-oxidanylidene-1,3-diphenyl-pyrimidin-5-yl)-(1,3-benzodioxol-5-yl)methyl]-6-oxidanyl-1,3-diphenyl-pyrimidin-4-one Openeye Name: 5-[1,3-benzodioxol-5-yl-(4-hydroxy-2-imino-6-oxo-1,3-diphenyl-pyrimidin-5-yl)methyl]-6-hydroxy-2-imino-1,3-diphenyl-pyrimidin-4-one CAS Name: 5-[1,3-benzodioxol-5-yl-(4-hydroxy-2-imino-6-oxo-1,3-diphenyl-5-pyrimidinyl)methyl]-6-hydroxy-2-imino-1,3-diphenyl-4-pyrimidinone IUPAC Name: 5-[1,3-benzodioxol-5-yl-(4-hydroxy-2-imino-6-oxo-1,3-diphenylpyrimidin-5-yl)methyl]-6-hydroxy-2-imino-1,3-diphenylpyrimidin-4-one Traditional Name: 5-[1,3-benzodioxol-5-yl-(4-hydroxy-2-imino-6-keto-1,3-diphenyl-pyrimidin-5-yl)methyl]-6-hydroxy-2-imino-1,3-diphenyl-pyrimidin-4-one Formula: C40H30N6O6 MolecularWeight: 690.7028

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C3=C(N(C(=N)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)O)C6=C(N(C(=N)N(C6=O)C7=CC=CC=C7)C8=CC=CC=C8)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C3=C(N(C(=N)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)O)C6=C(N(C(=N)N(C6=O)C7=CC=CC=C7)C8=CC=CC=C8)O

InChI

InChI=1S/C40H30N6O6/c41-39-43(26-13-5-1-6-14-26)35(47)33(36(48)44(39)27-15-7-2-8-16-27)32(25-21-22-30-31(23-25)52-24-51-30)34-37(49)45(28-17-9-3-10-18-28)40(42)46(38(34)50)29-19-11-4-12-20-29/h1-23,32,41-42,47,49H,24H2