2-[(4-tert-butylphenyl)methyl]-3-methyl-naphthalene-1,4-dione

Systemtic Name: 2-[(4-tert-butylphenyl)methyl]-3-methyl-naphthalene-1,4-dione Openeye Name: 2-[(4-tert-butylphenyl)methyl]-3-methyl-naphthalene-1,4-dione CAS Name: 2-[(4-tert-butylphenyl)methyl]-3-methylnaphthalene-1,4-dione IUPAC Name: 2-[(4-tert-butylphenyl)methyl]-3-methylnaphthalene-1,4-dione Traditional Name: 2-(4-tert-butylbenzyl)-3-methyl-1,4-naphthoquinone Formula: C22H22O2 MolecularWeight: 318.40888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H22O2/c1-14-19(13-15-9-11-16(12-10-15)22(2,3)4)21(24)18-8-6-5-7-17(18)20(14)23/h5-12H,13H2,1-4H3