7-[7-(2,6-dimethyl-8-oxidanyl-8-oxidanylidene-octan-2-yl)anthracen-2-yl]-3,7-dimethyl-octanoic acid

Systemtic Name: 7-[7-(2,6-dimethyl-8-oxidanyl-8-oxidanylidene-octan-2-yl)anthracen-2-yl]-3,7-dimethyl-octanoic acid Openeye Name: 7-[7-(7-hydroxy-1,1,5-trimethyl-7-oxo-heptyl)-2-anthryl]-3,7-dimethyl-octanoic acid CAS Name: 7-[7-(8-hydroxy-2,6-dimethyl-8-oxooctan-2-yl)-2-anthracenyl]-3,7-dimethyloctanoic acid IUPAC Name: 7-[7-(8-hydroxy-2,6-dimethyl-8-oxooctan-2-yl)anthracen-2-yl]-3,7-dimethyloctanoic acid Traditional Name: 7-[7-(7-hydroxy-7-keto-1,1,5-trimethyl-heptyl)-2-anthryl]-3,7-dimethyl-caprylic acid Formula: C34H46O4 MolecularWeight: 518.72664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)C1=CC2=CC3=C(C=CC(=C3)C(C)(C)CCCC(C)CC(=O)O)C=C2C=C1)CC(=O)O

Isomeric SMILES

CC(CCCC(C)(C)C1=CC2=CC3=C(C=CC(=C3)C(C)(C)CCCC(C)CC(=O)O)C=C2C=C1)CC(=O)O

InChI

InChI=1S/C34H46O4/c1-23(17-31(35)36)9-7-15-33(3,4)29-13-11-25-19-26-12-14-30(22-28(26)20-27(25)21-29)34(5,6)16-8-10-24(2)18-32(37)38/h11-14,19-24H,7-10,15-18H2,1-6H3,(H,35,36)(H,37,38)