CAS Registry Number®
83968-86-9
CAS Name
9,10-Anthracenedione, 1-amino-4-[[3-[(dimethylamino)methyl]phenyl]amino]-, acetate (1:1)
Molecular Formula
C23H21N3O2.C2H4O2
Other Names and Identifiers
InChI
InChI=1S/C23H21N3O2.C2H4O2/c1-26(2)13-14-6-5-7-15(12-14)25-19-11-10-18(24)20-21(19)23(28)17-9-4-3-8-16(17)22(20)27;1-2(3)4/h3-12,25H,13,24H2,1-2H3;1H3,(H,3,4)
InChIKey
InChIKey=BRGUEQVFTPNNLP-UHFFFAOYSA-N
SMILES
N(C1=C2C(C(=O)C=3C(C2=O)=CC=CC3)=C(N)C=C1)C4=CC(CN(C)C)=CC=C4.C(C)(O)=O
Canonical SMILES
O=C(O)C.O=C1C=2C=CC=CC2C(=O)C=3C(=CC=C(N)C13)NC4=CC=CC(=C4)CN(C)C
Other Names for this Substance
- 9,10-Anthracenedione, 1-amino-4-[[3-[(dimethylamino)methyl]phenyl]amino]-, acetate (1:1)
- 9,10-Anthracenedione, 1-amino-4-[[3-[(dimethylamino)methyl]phenyl]amino]-, monoacetate