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1-[2-(dibutylamino)ethylamino]-4-nitro-thioxanthen-9-one chloride

1-[2-(dibutylamino)ethylamino]-4-nitro-thioxanthen-9-one chloride

Systemtic Name:1-[2-(dibutylamino)ethylamino]-4-nitro-thioxanthen-9-one chloride
Openeye Name:1-[2-(dibutylamino)ethylamino]-4-nitro-thioxanthen-9-one chloride
CAS Name:1-[2-(dibutylamino)ethylamino]-4-nitro-9-thioxanthenone chloride
IUPAC Name:1-[2-(dibutylamino)ethylamino]-4-nitrothioxanthen-9-one chloride
Traditional Name:1-[2-(dibutylamino)ethylamino]-4-nitro-thioxanthen-9-one chloride
Formula: C23H29ClN3O3S-
MolecularWeight: 463.01266
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCNC1=C2C(=C(C=C1)[N+](=O)[O-])SC3=CC=CC=C3C2=O.[Cl-]


Isomeric SMILES

CCCCN(CCCC)CCNC1=C2C(=C(C=C1)[N+](=O)[O-])SC3=CC=CC=C3C2=O.[Cl-]


InChI

InChI=1S/C23H29N3O3S.ClH/c1-3-5-14-25(15-6-4-2)16-13-24-18-11-12-19(26(28)29)23-21(18)22(27)17-9-7-8-10-20(17)30-23;/h7-12,24H,3-6,13-16H2,1-2H3;1H/p-1


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