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

Systemtic Name: 2-ethoxy-6-[[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-ethoxy-6-[[2-methyl-5-(1-piperidylsulfonyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-ethoxy-6-[[2-methyl-5-(1-piperidinylsulfonyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-ethoxy-6-[(2-methyl-5-piperidin-1-ylsulfonylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-ethoxy-6-[(2-methyl-5-piperidinosulfonyl-anilino)methylene]cyclohexa-2,4-dien-1-one Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C)C1=O

InChI

InChI=1S/C21H26N2O4S/c1-3-27-20-9-7-8-17(21(20)24)15-22-19-14-18(11-10-16(19)2)28(25,26)23-12-5-4-6-13-23/h7-11,14-15,22H,3-6,12-13H2,1-2H3