(3E)-3-(2-chloranylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; methanesulfonic acid

Systemtic Name: (3E)-3-(2-chloranylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; methanesulfonic acid Openeye Name: (3E)-3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; methanesulfonic acid CAS Name: (3E)-3-(2-chloro-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine; methanesulfonic acid IUPAC Name: (3E)-3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine; methanesulfonic acid Traditional Name: [(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]-dimethyl-amine; mesylic acid Formula: C19H22ClNO3S2 MolecularWeight: 411.96588

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.CS(=O)(=O)O

Isomeric SMILES

CN(C)CC/C=C/1\C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.CS(=O)(=O)O

InChI

InChI=1S/C18H18ClNS.CH4O3S/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18;1-5(2,3)4/h3-4,6-10,12H,5,11H2,1-2H3;1H3,(H,2,3,4)/b14-7+;