N,N-dimethyl-4-(9H-thioxanthen-9-yl)butan-1-amine; ethanedioic acid

Systemtic Name: N,N-dimethyl-4-(9H-thioxanthen-9-yl)butan-1-amine; ethanedioic acid Openeye Name: N,N-dimethyl-4-(9H-thioxanthen-9-yl)butan-1-amine; oxalic acid CAS Name: N,N-dimethyl-4-(9H-thioxanthen-9-yl)-1-butanamine; oxalic acid IUPAC Name: N,N-dimethyl-4-(9H-thioxanthen-9-yl)butan-1-amine; oxalic acid Traditional Name: dimethyl-[4-(9H-thioxanthen-9-yl)butyl]amine; oxalic acid Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCC1C2=CC=CC=C2SC3=CC=CC=C13.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCCCC1C2=CC=CC=C2SC3=CC=CC=C13.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23NS.C2H2O4/c1-20(2)14-8-7-9-15-16-10-3-5-12-18(16)21-19-13-6-4-11-17(15)19;3-1(4)2(5)6/h3-6,10-13,15H,7-9,14H2,1-2H3;(H,3,4)(H,5,6)