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

Systemtic Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethoxy]benzonitrile Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)COC2=CC=CC(=C2)C#N)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)COC2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C18H20N2O2/c1-4-8-20-13(2)9-17(14(20)3)18(21)12-22-16-7-5-6-15(10-16)11-19/h5-7,9-10H,4,8,12H2,1-3H3