4-chloranyl-6-[[[2-(dimethylaminomethyl)phenyl]methylamino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[[2-(dimethylaminomethyl)phenyl]methylamino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[[2-(dimethylaminomethyl)phenyl]methylamino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[[2-(dimethylaminomethyl)phenyl]methylamino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[[2-(dimethylaminomethyl)phenyl]methylamino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[[2-(dimethylaminomethyl)benzyl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O3/c1-20(2)11-13-6-4-3-5-12(13)9-19-10-14-7-15(18)8-16(17(14)22)21(23)24/h3-8,10,19H,9,11H2,1-2H3