6-[[(3-methylsulfonylphenyl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(3-methylsulfonylphenyl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(3-methylsulfonylanilino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[(3-methylsulfonylanilino)methylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(3-methylsulfonylanilino)methylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[(3-mesylanilino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNC2=CC(=CC=C2)S(=O)(=O)C)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNC2=CC(=CC=C2)S(=O)(=O)C)C=C1

InChI

InChI=1S/C17H19NO4S/c1-3-9-22-15-8-7-13(17(19)11-15)12-18-14-5-4-6-16(10-14)23(2,20)21/h4-8,10-12,18H,3,9H2,1-2H3