OTAVA-FLUOR OTVD_0340

CAS No.
CCD No.
CCD00911762
Formula
C30 H35 N2 O2 S2 . C7 H7 O3 S
MolWeight
690.946

Basic Information

Product Name: OTAVA-FLUOR OTVD_0340
English Synonyms: OTAVA-FLUOR OTVD_0340
MDL Number.: MFCD10001289
H bond acceptor: 4
H bond donor: 2
Smile: Cc1ccc(cc1)S(=O)(=O)[O-].CC1(CC(=C/C(=C/c2[n+](c3ccccc3s2)CCCO)/C1)/C=C\4/N(c5ccccc5S4)CCCO)C
InChi: InChI=1S/C30H35N2O2S2.C7H8O3S/c1-30(2)20-22(18-28-31(13-7-15-33)24-9-3-5-11-26(24)35-28)17-23(21-30)19-29-32(14-8-16-34)25-10-4-6-12-27(25)36-29;1-6-2-4-7(5-3-6)11(8,9)10/h3-6,9-12,17-19,33-34H,7-8,13-16,20-21H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChiKey: InChIKey=QSZVANVQODEYKV-UHFFFAOYSA-M

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