4-chloranyl-3,5-dimethyl-6-[[(3-methylphenyl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-3,5-dimethyl-6-[[(3-methylphenyl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-3,5-dimethyl-6-[(3-methylanilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-3,5-dimethyl-6-[(3-methylanilino)methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-3,5-dimethyl-6-[(3-methylanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-3,5-dimethyl-6-(m-toluidinomethylene)-2-nitro-cyclohexa-2,4-dien-1-one Formula: C16H15ClN2O3 MolecularWeight: 318.7549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC=C2C(=C(C(=C(C2=O)[N+](=O)[O-])C)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)NC=C2C(=C(C(=C(C2=O)[N+](=O)[O-])C)Cl)C

InChI

InChI=1S/C16H15ClN2O3/c1-9-5-4-6-12(7-9)18-8-13-10(2)14(17)11(3)15(16(13)20)19(21)22/h4-8,18H,1-3H3