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

Systemtic Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(1-isopentyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)-3-pyrrolyl]-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-(1-isoamyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethoxy]benzonitrile Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(C)C)C)C(=O)COC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC(=C(N1CCC(C)C)C)C(=O)COC2=CC=CC(=C2)C#N

InChI

InChI=1S/C20H24N2O2/c1-14(2)8-9-22-15(3)10-19(16(22)4)20(23)13-24-18-7-5-6-17(11-18)12-21/h5-7,10-11,14H,8-9,13H2,1-4H3