benzene-1,4-diol; 3-oxidanyl-2-phenyl-chromen-4-one; pyrene

Systemtic Name: benzene-1,4-diol; 3-oxidanyl-2-phenyl-chromen-4-one; pyrene Openeye Name: benzene-1,4-diol; 3-hydroxy-2-phenyl-chromen-4-one; pyrene CAS Name: benzene-1,4-diol; 3-hydroxy-2-phenyl-1-benzopyran-4-one; pyrene IUPAC Name: benzene-1,4-diol; 3-hydroxy-2-phenylchromen-4-one; pyrene Traditional Name: hydroquinone; 3-hydroxy-2-phenyl-chromone; pyrene Formula: C37H26O5 MolecularWeight: 550.59934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O.C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.C1=CC(=CC=C1O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O.C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.C1=CC(=CC=C1O)O

InChI

InChI=1S/C16H10.C15H10O3.C6H6O2/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;16-13-11-8-4-5-9-12(11)18-15(14(13)17)10-6-2-1-3-7-10;7-5-1-2-6(8)4-3-5/h1-10H;1-9,17H;1-4,7-8H