4-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-keto-ethoxy]benzonitrile Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H18N2O2/c1-15-12-20(16(2)23(15)18-6-4-3-5-7-18)21(24)14-25-19-10-8-17(13-22)9-11-19/h3-12H,14H2,1-2H3