(5E)-5-[[(3-chloranyl-4-methyl-phenyl)amino]methylidene]-4-methyl-2,6-bis(oxidanylidene)-1-(phenylmethyl)pyridine-3-carbonitrile

Systemtic Name: (5E)-5-[[(3-chloranyl-4-methyl-phenyl)amino]methylidene]-4-methyl-2,6-bis(oxidanylidene)-1-(phenylmethyl)pyridine-3-carbonitrile Openeye Name: (5E)-1-benzyl-5-[(3-chloro-4-methyl-anilino)methylene]-4-methyl-2,6-dioxo-pyridine-3-carbonitrile CAS Name: (5E)-5-[(3-chloro-4-methylanilino)methylidene]-4-methyl-2,6-dioxo-1-(phenylmethyl)-3-pyridinecarbonitrile IUPAC Name: (5E)-1-benzyl-5-[(3-chloro-4-methylanilino)methylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile Traditional Name: (5E)-1-benzyl-5-[(3-chloro-4-methyl-anilino)methylene]-2,6-diketo-4-methyl-nicotinonitrile Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C2C(=C(C(=O)N(C2=O)CC3=CC=CC=C3)C#N)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N/C=C/2\C(=C(C(=O)N(C2=O)CC3=CC=CC=C3)C#N)C)Cl

InChI

InChI=1S/C22H18ClN3O2/c1-14-8-9-17(10-20(14)23)25-12-19-15(2)18(11-24)21(27)26(22(19)28)13-16-6-4-3-5-7-16/h3-10,12,25H,13H2,1-2H3/b19-12+