1,8-bis(heptylamino)anthracene-9,10-dione

Systemtic Name: 1,8-bis(heptylamino)anthracene-9,10-dione Openeye Name: 1,8-bis(heptylamino)anthracene-9,10-dione CAS Name: 1,8-bis(heptylamino)anthracene-9,10-dione IUPAC Name: 1,8-bis(heptylamino)anthracene-9,10-dione Traditional Name: 1,8-bis(heptylamino)-9,10-anthraquinone Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC=CC2=C1C(=O)C3=C(C2=O)C=CC=C3NCCCCCCC

Isomeric SMILES

CCCCCCCNC1=CC=CC2=C1C(=O)C3=C(C2=O)C=CC=C3NCCCCCCC

InChI

InChI=1S/C28H38N2O2/c1-3-5-7-9-11-19-29-23-17-13-15-21-25(23)28(32)26-22(27(21)31)16-14-18-24(26)30-20-12-10-8-6-4-2/h13-18,29-30H,3-12,19-20H2,1-2H3