6-[[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C1=O

Isomeric SMILES

COC1=CC=CC(=CNCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C1=O

InChI

InChI=1S/C18H20N2O6/c1-24-15-6-4-5-13(18(15)21)11-19-8-7-12-9-16(25-2)17(26-3)10-14(12)20(22)23/h4-6,9-11,19H,7-8H2,1-3H3