2-chloranyl-3,6-bis(4-methoxyphenyl)-5-phenylmethoxy-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-chloranyl-3,6-bis(4-methoxyphenyl)-5-phenylmethoxy-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-benzyloxy-5-chloro-3,6-bis(4-methoxyphenyl)-1,4-benzoquinone CAS Name: 2-chloro-3,6-bis(4-methoxyphenyl)-5-phenylmethoxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-chloro-3,6-bis(4-methoxyphenyl)-5-phenylmethoxycyclohexa-2,5-diene-1,4-dione Traditional Name: 2-benzoxy-5-chloro-3,6-bis(4-methoxyphenyl)-p-benzoquinone Formula: C27H21ClO5 MolecularWeight: 460.90564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)C(=C(C2=O)Cl)C3=CC=C(C=C3)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)C(=C(C2=O)Cl)C3=CC=C(C=C3)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C27H21ClO5/c1-31-20-12-8-18(9-13-20)22-24(28)25(29)23(19-10-14-21(32-2)15-11-19)27(26(22)30)33-16-17-6-4-3-5-7-17/h3-15H,16H2,1-2H3