3,3-dimethyl-1-(2-phenylpyridin-4-yl)oxy-1-pyrrol-1-yl-butan-2-one

Systemtic Name: 3,3-dimethyl-1-(2-phenylpyridin-4-yl)oxy-1-pyrrol-1-yl-butan-2-one Openeye Name: 3,3-dimethyl-1-[(2-phenyl-4-pyridyl)oxy]-1-pyrrol-1-yl-butan-2-one CAS Name: 3,3-dimethyl-1-[(2-phenyl-4-pyridinyl)oxy]-1-(1-pyrrolyl)-2-butanone IUPAC Name: 3,3-dimethyl-1-(2-phenylpyridin-4-yl)oxy-1-pyrrol-1-ylbutan-2-one Traditional Name: 3,3-dimethyl-1-[(2-phenyl-4-pyridyl)oxy]-1-pyrrol-1-yl-butan-2-one Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(N1C=CC=C1)OC2=CC(=NC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)C(N1C=CC=C1)OC2=CC(=NC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-21(2,3)19(24)20(23-13-7-8-14-23)25-17-11-12-22-18(15-17)16-9-5-4-6-10-16/h4-15,20H,1-3H3