4-chloranyl-6-[[3-[methyl(phenyl)amino]propylamino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[3-[methyl(phenyl)amino]propylamino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[3-(N-methylanilino)propylamino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[3-(N-methylanilino)propylamino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[3-(N-methylanilino)propylamino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[3-(N-methylanilino)propylamino]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(CCCNC=C1C=C(C=C(C1=O)[N+](=O)[O-])Cl)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC=C1C=C(C=C(C1=O)[N+](=O)[O-])Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H18ClN3O3/c1-20(15-6-3-2-4-7-15)9-5-8-19-12-13-10-14(18)11-16(17(13)22)21(23)24/h2-4,6-7,10-12,19H,5,8-9H2,1H3