3-[[2-(4-methylphenyl)carbonylpyrrol-1-yl]methyl]quinoxaline-5-carbonitrile

Systemtic Name: 3-[[2-(4-methylphenyl)carbonylpyrrol-1-yl]methyl]quinoxaline-5-carbonitrile Openeye Name: 3-[[2-(4-methylbenzoyl)pyrrol-1-yl]methyl]quinoxaline-5-carbonitrile CAS Name: 3-[[2-[(4-methylphenyl)-oxomethyl]-1-pyrrolyl]methyl]-5-quinoxalinecarbonitrile IUPAC Name: 3-[[2-(4-methylbenzoyl)pyrrol-1-yl]methyl]quinoxaline-5-carbonitrile Traditional Name: 3-[(2-p-toluoylpyrrol-1-yl)methyl]quinoxaline-5-carbonitrile Formula: C22H16N4O MolecularWeight: 352.38864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CN2CC3=NC4=C(C=CC=C4N=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CN2CC3=NC4=C(C=CC=C4N=C3)C#N

InChI

InChI=1S/C22H16N4O/c1-15-7-9-16(10-8-15)22(27)20-6-3-11-26(20)14-18-13-24-19-5-2-4-17(12-23)21(19)25-18/h2-11,13H,14H2,1H3