6-[[(4-dimethylaminophenyl)amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(4-dimethylaminophenyl)amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: 4-benzyl-6-[[4-(dimethylamino)anilino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(dimethylamino)anilino]methylidene]-2-nitro-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: 4-benzyl-6-[[4-(dimethylamino)anilino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-benzyl-6-[[4-(dimethylamino)anilino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3/c1-24(2)20-10-8-19(9-11-20)23-15-18-13-17(12-16-6-4-3-5-7-16)14-21(22(18)26)25(27)28/h3-11,13-15,23H,12H2,1-2H3