(4E)-2-bromanyl-6-methoxy-4-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-bromanyl-6-methoxy-4-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-bromo-6-methoxy-4-[[4-methyl-3-(1-piperidylsulfonyl)anilino]methylene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-bromo-6-methoxy-4-[[4-methyl-3-(1-piperidinylsulfonyl)anilino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-bromo-6-methoxy-4-[(4-methyl-3-piperidin-1-ylsulfonylanilino)methylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-bromo-6-methoxy-4-[(4-methyl-3-piperidinosulfonyl-anilino)methylene]cyclohexa-2,5-dien-1-one Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C2C=C(C(=O)C(=C2)Br)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)N/C=C/2\C=C(C(=O)C(=C2)Br)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H23BrN2O4S/c1-14-6-7-16(12-19(14)28(25,26)23-8-4-3-5-9-23)22-13-15-10-17(21)20(24)18(11-15)27-2/h6-7,10-13,22H,3-5,8-9H2,1-2H3/b15-13-