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

Systemtic Name: 4-[2-(2,5-dimethyl-1-pyridin-2-yl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-[2,5-dimethyl-1-(2-pyridyl)pyrrol-3-yl]-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-[2,5-dimethyl-1-(2-pyridinyl)-3-pyrrolyl]-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-(2,5-dimethyl-1-pyridin-2-ylpyrrol-3-yl)-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-[2,5-dimethyl-1-(2-pyridyl)pyrrol-3-yl]-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)COC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)COC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C21H19N3O3/c1-14-10-17(15(2)24(14)21-6-4-5-9-23-21)18(25)13-27-19-8-7-16(12-22)11-20(19)26-3/h4-11H,13H2,1-3H3