acetyloxymethyl 3',6'-diacetyloxy-2'-chloranyl-7'-(10-methylanthracen-9-yl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylate

Systemtic Name: acetyloxymethyl 3',6'-diacetyloxy-2'-chloranyl-7'-(10-methylanthracen-9-yl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylate Openeye Name: acetoxymethyl 3',6'-diacetoxy-2'-chloro-7'-(10-methyl-9-anthryl)-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-carboxylate CAS Name: 3',6'-diacetyloxy-2'-chloro-7'-(10-methyl-9-anthracenyl)-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]carboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 3',6'-diacetyloxy-2'-chloro-7'-(10-methylanthracen-9-yl)-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carboxylate Traditional Name: 3',6'-diacetoxy-2'-chloro-3-keto-7'-(10-methyl-9-anthryl)spiro[phthalan-1,9'-xanthene]-5-carboxylic acid acetoxymethyl ester Formula: C43H29ClO11 MolecularWeight: 757.13676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC5=C(C=C4OC(=O)C)OC6=CC(=C(C=C6C57C8=C(C=C(C=C8)C(=O)OCOC(=O)C)C(=O)O7)Cl)OC(=O)C

Isomeric SMILES

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC5=C(C=C4OC(=O)C)OC6=CC(=C(C=C6C57C8=C(C=C(C=C8)C(=O)OCOC(=O)C)C(=O)O7)Cl)OC(=O)C

InChI

InChI=1S/C43H29ClO11/c1-21-26-9-5-7-11-28(26)40(29-12-8-6-10-27(21)29)31-16-33-37(18-36(31)52-23(3)46)54-38-19-39(53-24(4)47)35(44)17-34(38)43(33)32-14-13-25(15-30(32)42(49)55-43)41(48)51-20-50-22(2)45/h5-19H,20H2,1-4H3