9a-chloranyl-10-methyl-10-oxidanyl-8-phenylmethoxy-4,4a-dihydroanthracene-1,9-dione

Systemtic Name: 9a-chloranyl-10-methyl-10-oxidanyl-8-phenylmethoxy-4,4a-dihydroanthracene-1,9-dione Openeye Name: 8-benzyloxy-9a-chloro-10-hydroxy-10-methyl-4,4a-dihydroanthracene-1,9-dione CAS Name: 9a-chloro-10-hydroxy-10-methyl-8-phenylmethoxy-4,4a-dihydroanthracene-1,9-dione IUPAC Name: 9a-chloro-10-hydroxy-10-methyl-8-phenylmethoxy-4,4a-dihydroanthracene-1,9-dione Traditional Name: 8-benzoxy-9a-chloro-10-hydroxy-10-methyl-4,4a-dihydroanthracene-1,9-quinone Formula: C22H19ClO4 MolecularWeight: 382.83686

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC=CC(=O)C2(C(=O)C3=C1C=CC=C3OCC4=CC=CC=C4)Cl)O

Isomeric SMILES

CC1(C2CC=CC(=O)C2(C(=O)C3=C1C=CC=C3OCC4=CC=CC=C4)Cl)O

InChI

InChI=1S/C22H19ClO4/c1-21(26)15-9-5-10-16(27-13-14-7-3-2-4-8-14)19(15)20(25)22(23)17(21)11-6-12-18(22)24/h2-10,12,17,26H,11,13H2,1H3