(6E)-6-[[[4-(azepan-1-ylsulfonyl)phenyl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[[4-(azepan-1-ylsulfonyl)phenyl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[4-(azepan-1-ylsulfonyl)anilino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[4-(1-azepanylsulfonyl)anilino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[4-(azepan-1-ylsulfonyl)anilino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[4-(azepan-1-ylsulfonyl)anilino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C1=O

Isomeric SMILES

COC1=CC=C/C(=C\NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)/C1=O

InChI

InChI=1S/C20H24N2O4S/c1-26-19-8-6-7-16(20(19)23)15-21-17-9-11-18(12-10-17)27(24,25)22-13-4-2-3-5-14-22/h6-12,15,21H,2-5,13-14H2,1H3/b16-15+