methyl 7-[7-(8-methoxy-2,6-dimethyl-8-oxidanylidene-octan-2-yl)anthracen-2-yl]-3,7-dimethyl-octanoate

Systemtic Name: methyl 7-[7-(8-methoxy-2,6-dimethyl-8-oxidanylidene-octan-2-yl)anthracen-2-yl]-3,7-dimethyl-octanoate Openeye Name: methyl 7-[7-(7-methoxy-1,1,5-trimethyl-7-oxo-heptyl)-2-anthryl]-3,7-dimethyl-octanoate CAS Name: 7-[7-(8-methoxy-2,6-dimethyl-8-oxooctan-2-yl)-2-anthracenyl]-3,7-dimethyloctanoic acid methyl ester IUPAC Name: methyl 7-[7-(8-methoxy-2,6-dimethyl-8-oxooctan-2-yl)anthracen-2-yl]-3,7-dimethyloctanoate Traditional Name: 7-[7-(7-keto-7-methoxy-1,1,5-trimethyl-heptyl)-2-anthryl]-3,7-dimethyl-caprylic acid methyl ester Formula: C36H50O4 MolecularWeight: 546.7798

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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)OC)C=C2C=C1)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C36H50O4/c1-25(19-33(37)39-7)11-9-17-35(3,4)31-15-13-27-21-28-14-16-32(24-30(28)22-29(27)23-31)36(5,6)18-10-12-26(2)20-34(38)40-8/h13-16,21-26H,9-12,17-20H2,1-8H3