7-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-3,7-dimethyl-octanenitrile

Systemtic Name: 7-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-3,7-dimethyl-octanenitrile Openeye Name: 7-(7-tert-butyl-9,10-dioxo-2-anthryl)-3,7-dimethyl-octanenitrile CAS Name: 7-(7-tert-butyl-9,10-dioxo-2-anthracenyl)-3,7-dimethyloctanenitrile IUPAC Name: 7-(7-tert-butyl-9,10-dioxoanthracen-2-yl)-3,7-dimethyloctanenitrile Traditional Name: 7-(7-tert-butyl-9,10-diketo-2-anthryl)-3,7-dimethyl-caprylonitrile Formula: C28H33NO2 MolecularWeight: 415.56712

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)C)CC#N

Isomeric SMILES

CC(CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)C)CC#N

InChI

InChI=1S/C28H33NO2/c1-18(13-15-29)8-7-14-28(5,6)20-10-12-22-24(17-20)26(31)23-16-19(27(2,3)4)9-11-21(23)25(22)30/h9-12,16-18H,7-8,13-14H2,1-6H3