3-[3-(3-cycloheptylphenyl)propyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[3-(3-cycloheptylphenyl)propyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[3-(3-cycloheptylphenyl)propyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[3-(3-cycloheptylphenyl)propyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[3-(3-cycloheptylphenyl)propyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[3-(3-cycloheptylphenyl)propyl]-4-hydroxy-1,2-naphthoquinone Formula: C26H28O3 MolecularWeight: 388.49872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=CC(=CC=C2)CCCC3=C(C4=CC=CC=C4C(=O)C3=O)O

Isomeric SMILES

C1CCCC(CC1)C2=CC(=CC=C2)CCCC3=C(C4=CC=CC=C4C(=O)C3=O)O

InChI

InChI=1S/C26H28O3/c27-24-21-14-5-6-15-22(21)25(28)26(29)23(24)16-8-10-18-9-7-13-20(17-18)19-11-3-1-2-4-12-19/h5-7,9,13-15,17,19,27H,1-4,8,10-12,16H2