[1-[(7-isocyanoquinoxalin-2-yl)methyl]pyrrol-2-yl]-(4-methylphenyl)methanone

Systemtic Name: [1-[(7-isocyanoquinoxalin-2-yl)methyl]pyrrol-2-yl]-(4-methylphenyl)methanone Openeye Name: [1-[(7-isocyanoquinoxalin-2-yl)methyl]pyrrol-2-yl]-(p-tolyl)methanone CAS Name: [1-[(7-isocyano-2-quinoxalinyl)methyl]-2-pyrrolyl]-(4-methylphenyl)methanone IUPAC Name: [1-[(7-isocyanoquinoxalin-2-yl)methyl]pyrrol-2-yl]-(4-methylphenyl)methanone Traditional Name: [1-[(7-isocyanoquinoxalin-2-yl)methyl]pyrrol-2-yl]-(p-tolyl)methanone 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=CN=C4C=CC(=CC4=N3)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CN2CC3=CN=C4C=CC(=CC4=N3)[N+]#[C-]

InChI

InChI=1S/C22H16N4O/c1-15-5-7-16(8-6-15)22(27)21-4-3-11-26(21)14-18-13-24-19-10-9-17(23-2)12-20(19)25-18/h3-13H,14H2,1H3