4-[[(4-chlorophenyl)methylamino]-sulfanyl-methylidene]-2-methoxy-6-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(4-chlorophenyl)methylamino]-sulfanyl-methylidene]-2-methoxy-6-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(4-chlorophenyl)methylamino]-sulfanyl-methylene]-2-hydroxy-6-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(4-chlorophenyl)methylamino]-mercaptomethylidene]-2-hydroxy-6-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(4-chlorophenyl)methylamino]-sulfanylmethylidene]-2-hydroxy-6-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(4-chlorobenzyl)amino]-mercapto-methylene]-2-hydroxy-6-methoxy-cyclohexa-2,5-dien-1-one Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(NCC2=CC=C(C=C2)Cl)S)C=C(C1=O)O

Isomeric SMILES

COC1=CC(=C(NCC2=CC=C(C=C2)Cl)S)C=C(C1=O)O

InChI

InChI=1S/C15H14ClNO3S/c1-20-13-7-10(6-12(18)14(13)19)15(21)17-8-9-2-4-11(16)5-3-9/h2-7,17-18,21H,8H2,1H3