1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid

Systemtic Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid Openeye Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid CAS Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid IUPAC Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid Traditional Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)-9,10-anthraquinone; 2-ethylhexanoic acid Formula: C35H53N3O4 MolecularWeight: 579.81302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC1=C2C(=C(C=C1)NCCCN(C)C)C(=O)C3=CC=CC=C3C2=O.CCCCC(CC)C(=O)O

Isomeric SMILES

CCCCC(CC)CNC1=C2C(=C(C=C1)NCCCN(C)C)C(=O)C3=CC=CC=C3C2=O.CCCCC(CC)C(=O)O

InChI

InChI=1S/C27H37N3O2.C8H16O2/c1-5-7-11-19(6-2)18-29-23-15-14-22(28-16-10-17-30(3)4)24-25(23)27(32)21-13-9-8-12-20(21)26(24)31;1-3-5-6-7(4-2)8(9)10/h8-9,12-15,19,28-29H,5-7,10-11,16-18H2,1-4H3;7H,3-6H2,1-2H3,(H,9,10)