methyl 7-anthracen-2-yl-3,7-dimethyl-octanoate

Systemtic Name: methyl 7-anthracen-2-yl-3,7-dimethyl-octanoate Openeye Name: methyl 7-(2-anthryl)-3,7-dimethyl-octanoate CAS Name: 7-(2-anthracenyl)-3,7-dimethyloctanoic acid methyl ester IUPAC Name: methyl 7-anthracen-2-yl-3,7-dimethyloctanoate Traditional Name: 7-(2-anthryl)-3,7-dimethyl-caprylic acid methyl ester Formula: C25H30O2 MolecularWeight: 362.5045

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)C1=CC2=CC3=CC=CC=C3C=C2C=C1)CC(=O)OC

Isomeric SMILES

CC(CCCC(C)(C)C1=CC2=CC3=CC=CC=C3C=C2C=C1)CC(=O)OC

InChI

InChI=1S/C25H30O2/c1-18(14-24(26)27-4)8-7-13-25(2,3)23-12-11-21-15-19-9-5-6-10-20(19)16-22(21)17-23/h5-6,9-12,15-18H,7-8,13-14H2,1-4H3