1-butoxy-2,3-bis[(2-ethoxy-6-methyl-phenyl)amino]-4-fluoranyl-5,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1-butoxy-2,3-bis[(2-ethoxy-6-methyl-phenyl)amino]-4-fluoranyl-5,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1-butoxy-2,3-bis(2-ethoxy-6-methyl-anilino)-4-fluoro-5,8-dihydroxy-anthracene-9,10-dione CAS Name: 1-butoxy-2,3-bis(2-ethoxy-6-methylanilino)-4-fluoro-5,8-dihydroxyanthracene-9,10-dione IUPAC Name: 1-butoxy-2,3-bis(2-ethoxy-6-methylanilino)-4-fluoro-5,8-dihydroxyanthracene-9,10-dione Traditional Name: 1-butoxy-2,3-bis(2-ethoxy-6-methyl-anilino)-4-fluoro-5,8-dihydroxy-9,10-anthraquinone Formula: C36H37FN2O7 MolecularWeight: 628.686583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)O)F)NC4=C(C=CC=C4OCC)C)NC5=C(C=CC=C5OCC)C

Isomeric SMILES

CCCCOC1=C(C(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)O)F)NC4=C(C=CC=C4OCC)C)NC5=C(C=CC=C5OCC)C

InChI

InChI=1S/C36H37FN2O7/c1-6-9-18-46-36-28-27(34(42)25-21(40)16-17-22(41)26(25)35(28)43)29(37)32(38-30-19(4)12-10-14-23(30)44-7-2)33(36)39-31-20(5)13-11-15-24(31)45-8-3/h10-17,38-41H,6-9,18H2,1-5H3