(Z)-but-2-enedioic acid; 2-chloranyl-9-[3-(dimethylamino)propylidene]thioxanthen-4-ol

Systemtic Name: (Z)-but-2-enedioic acid; 2-chloranyl-9-[3-(dimethylamino)propylidene]thioxanthen-4-ol Openeye Name: 2-chloro-9-[3-(dimethylamino)propylidene]thioxanthen-4-ol; maleic acid CAS Name: (Z)-2-butenedioic acid; 2-chloro-9-[3-(dimethylamino)propylidene]-4-thioxanthenol IUPAC Name: (Z)-but-2-enedioic acid; 2-chloro-9-[3-(dimethylamino)propylidene]thioxanthen-4-ol Traditional Name: 2-chloro-9-[3-(dimethylamino)propylidene]thioxanthen-4-ol; maleic acid Formula: C22H22ClNO5S MolecularWeight: 447.93178

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC=C1C2=CC=CC=C2SC3=C(C=C(C=C13)Cl)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCC=C1C2=CC=CC=C2SC3=C(C=C(C=C13)Cl)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C18H18ClNOS.C4H4O4/c1-20(2)9-5-7-13-14-6-3-4-8-17(14)22-18-15(13)10-12(19)11-16(18)21;5-3(6)1-2-4(7)8/h3-4,6-8,10-11,21H,5,9H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-