1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-oxidanyl-thioxanthen-9-one

Systemtic Name: 1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-oxidanyl-thioxanthen-9-one Openeye Name: 1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-hydroxy-thioxanthen-9-one CAS Name: 1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-hydroxy-9-thioxanthenone IUPAC Name: 1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-hydroxythioxanthen-9-one Traditional Name: 1-[2-[bis(2-chloroethyl)amino]ethoxy]-4-hydroxy-thioxanthen-9-one Formula: C19H19Cl2NO3S MolecularWeight: 412.33006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3S2)O)OCCN(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3S2)O)OCCN(CCCl)CCCl

InChI

InChI=1S/C19H19Cl2NO3S/c20-7-9-22(10-8-21)11-12-25-15-6-5-14(23)19-17(15)18(24)13-3-1-2-4-16(13)26-19/h1-6,23H,7-12H2