4-[(E)-[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-[2-(4-tert-butylphenyl)-5-oxo-oxazol-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-[2-(4-tert-butylphenyl)-5-oxo-4-oxazolylidene]methyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-[2-(4-tert-butylphenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C/2\C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H21N3O2/c1-13-15(10-17(12-22)24(13)5)11-18-20(25)26-19(23-18)14-6-8-16(9-7-14)21(2,3)4/h6-11H,1-5H3/b18-11+