Bisnafide dimesylate
CAS Registry Number®
145124-30-7
CAS Name
Bisnafide dimesylateMolecular Formula
C32H28N6O8.2CH4O3SCite this Page
Bisnafide dimesylate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=145124-30-7 (retrieved ) (CAS RN: 145124-30-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C32H28N6O8.CH4O3S/c1-17(35-29(39)23-7-3-5-19-11-21(37(43)44)13-25(27(19)23)31(35)41)15-33-9-10-34-16-18(2)36-30(40)24-8-4-6-20-12-22(38(45)46)14-26(28(20)24)32(36)42;1-5(2,3)4/h3-8,11-14,17-18,33-34H,9-10,15-16H2,1-2H3;1H3,(H,2,3,4)/t17-,18-;/m1./s1
InChIKey
InChIKey=JZLALHHQECURLW-JAXOOIEVSA-N
SMILES
O=C1C=2C=3C(C(=O)N1[C@@H](CNCCNC[C@@H](C)N4C(=O)C=5C=6C(C4=O)=CC=CC6C=C(N(=O)=O)C5)C)=CC=CC3C=C(N(=O)=O)C2.S(C)(=O)(=O)O
Canonical SMILES
O=C1C=2C=CC=C3C=C(C=C(C(=O)N1C(C)CNCCNCC(N4C(=O)C=5C=CC=C6C=C(C=C(C4=O)C65)N(=O)=O)C)C32)N(=O)=O.O=S(=O)(O)C
Other Names for this Substance
- 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2,2′-[1,2-ethanediylbis[imino[(1R)-1-methyl-2,1-ethanediyl]]]bis[5-nitro-, methanesulfonate (1:2)
- 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2,2′-[1,2-ethanediylbis[imino(1-methyl-2,1-ethanediyl)]]bis[5-nitro-, [R-(R*,R*)]-, dimethanesulfonate
- 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2,2′-[1,2-ethanediylbis[imino[(1R)-1-methyl-2,1-ethanediyl]]]bis[5-nitro-, dimethanesulfonate
- DMP 840
- Bisnafide dimesylate